Home Halogens Methyl chloroformate

Methyl chloroformate

CAS No.:
79-22-1
Catalog Number:
AG00534K
Molecular Formula:
C2H3ClO2
Molecular Weight:
94.4970
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Product Description
Catalog Number:
AG00534K
Chemical Name:
Methyl chloroformate
CAS Number:
79-22-1
Molecular Formula:
C2H3ClO2
Molecular Weight:
94.4970
MDL Number:
MFCD00000639
IUPAC Name:
methyl carbonochloridate
InChI:
InChI=1S/C2H3ClO2/c1-5-2(3)4/h1H3
InChI Key:
XMJHPCRAQCTCFT-UHFFFAOYSA-N
SMILES:
COC(=O)Cl
EC Number:
201-187-3
UNII:
RC6VA8OB2N
RTECS Number:
FG3675000
UN Number:
1238
Properties
Complexity:
42.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
93.982g/mol
Formal Charge:
0
Heavy Atom Count:
5  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
94.494g/mol
Monoisotopic Mass:
93.982g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Literature
Title Journal
Determination of amino acids in selenium-enriched yeast by gas chromatography-mass spectrometry after microwave assisted hydrolysis. Analytica chimica acta 20120926
Metabolic profiling of Lactococcus lactis under different culture conditions. Molecules (Basel, Switzerland) 20120703
Simultaneous extraction and derivatization of amino acids and free fatty acids in meat products. Journal of chromatography. A 20120608
Identification and synthesis of a male-produced pheromone for the neotropical root weevil Diaprepes abbreviatus. Journal of chemical ecology 20120401
Use of Linear Free Energy Relationships (LFERs) to elucidate the mechanisms of reaction of a γ-methyl-β-alkynyl and an ortho-substituted aryl chloroformate ester. International journal of molecular sciences 20120101
Species-specific chemical signatures in scale insect honeydew. Journal of chemical ecology 20111101
Vitamin B₁₂ deficiency & levels of metabolites in an apparently normal urban south Indian elderly population. The Indian journal of medical research 20111001
Improved enantiomer resolution and quantification of free D-amino acids in serum and urine by comprehensive two-dimensional gas chromatography-time-of-flight mass spectrometry. Journal of chromatography. A 20110715
Highly sensitive GC/MS/MS method for quantitation of amino and nonamino organic acids. Analytical chemistry 20110401
Convenient synthesis of 3,4-dichloro-5-hydroxy-2(5H)-furanone glycoconjugates. Molecules (Basel, Switzerland) 20110125
An automated growth enclosure for metabolic labeling of Arabidopsis thaliana with 13C-carbon dioxide - an in vivo labeling system for proteomics and metabolomics research. Proteome science 20110101
Revealing the beneficial effect of protease supplementation to high gravity beer fermentations using '-omics' techniques. Microbial cell factories 20110101
Correlation of the rates of solvolysis of neopentyl chloroformate-a recommended protecting agent. International journal of molecular sciences 20110101
iRsp1095: a genome-scale reconstruction of the Rhodobacter sphaeroides metabolic network. BMC systems biology 20110101
Correlation of the rates of solvolysis of i-butyl fluoroformate and a consideration of leaving-group effects. International journal of molecular sciences 20110101
Determination of octylphenol and nonylphenol in aqueous sample using simultaneous derivatization and dispersive liquid-liquid microextraction followed by gas chromatography-mass spectrometry. Journal of chromatography. A 20101022
Analytical platform for metabolome analysis of microbial cells using methyl chloroformate derivatization followed by gas chromatography-mass spectrometry. Nature protocols 20100901
Microscale analysis of amino acids using gas chromatography-mass spectrometry after methyl chloroformate derivatization. Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20100815
Characterization of the branched-chain amino acid aminotransferase enzyme family in tomato. Plant physiology 20100701
Comparison of derivatization and chromatographic methods for GC-MS analysis of amino acid enantiomers in physiological samples. Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20100501
Enantiomeric resolution of biomarkers in space analysis: Chemical derivatization and signal processing for gas chromatography-mass spectrometry analysis of chiral amino acids. Journal of chromatography. A 20100212
Fused bicyclic piperidines and dihydropyridines by dearomatising cyclisation of the enolates of nicotinyl-substituted esters and ketones. Beilstein journal of organic chemistry 20100101
Use of empirical correlations to determine solvent effects in the solvolysis of S-methyl chlorothioformate. International journal of molecular sciences 20100101
Analysis of the nucleophilic solvation effects in isopropyl chlorothioformate solvolysis. International journal of molecular sciences 20100101
Yeast biological networks unfold the interplay of antioxidants, genome and phenotype, and reveal a novel regulator of the oxidative stress response. PloS one 20100101
Grunwald-Winstein analysis: isopropyl chloroformate solvolysis revisited. International journal of molecular sciences 20090301
Corrrelation of the specific rates of solvolysis of ethyl fluoroformate using the extended Grunwald-Winstein equation. International journal of molecular sciences 20090301
Selective inhibition of carotenoid cleavage dioxygenases: phenotypic effects on shoot branching. The Journal of biological chemistry 20090220
Extended Grunwald-Winstein analysis - LFER used to gauge solvent effects in p-nitrophenyl chloroformate solvolysis. International journal of molecular sciences 20081101
Synthesis of azoxabicyclo[3.3.1]nonanones based on diastereoselective reactions of 1,1-bis(trimethylsilyloxy)ketene acetals with isoquinolines and quinolines. Organic & biomolecular chemistry 20080807
New nordihydroguaiaretic acid derivatives as anti-HIV agents. Bioorganic & medicinal chemistry letters 20080315
Identification of biomarkers for genotyping Aspergilli using non-linear methods for clustering and classification. BMC bioinformatics 20080101
Large-scale synthesis of a persistent trityl radical for use in biomedical EPR applications and imaging. Bioorganic & medicinal chemistry letters 20071215
The first solid enols of anhydrides. Structure, properties, and enol/anhydride equilibria(1). The Journal of organic chemistry 20071123
Gas chromatography-mass spectrometry analysis of amino acid enantiomers as methyl chloroformate derivatives: application to space analysis. Journal of chromatography. A 20070525
The oriented development of antituberculotics (Part II): halogenated 3-(4-alkylphenyl)-1,3-benzoxazine-2,4-(3H)-diones. Archiv der Pharmazie 20070501
Characterization of the methoxy carbonyl radical formed via photolysis of methyl chloroformate at 193.3 nm. The journal of physical chemistry. A 20070315
Enantiomeric analysis of amino acids by using comprehensive two-dimensional gas chromatography. Chirality 20070301
Quantitative profiling of folate and one-carbon metabolism in large-scale epidemiological studies by mass spectrometry. Clinical chemistry and laboratory medicine 20070101
An evaluation of GC-MS and HPLC-FD methods for analysis of protein binders in paintings. Journal of separation science 20061101
Study of the microbiodegradation of terpenoid resin-based varnishes from easel painting using pyrolysis-gas chromatography-mass spectrometry and gas chromatography-mass spectrometry. Analytical and bioanalytical chemistry 20060801
Analysis of phenolic acids as chloroformate derivatives using solid phase microextraction-gas chromatography. Analytica chimica acta 20060728
Unimolecular dissociation of the CH3OCO radical: an intermediate in the CH3O + CO reaction. The journal of physical chemistry. A 20060202
Do alpha-acyloxy and alpha-alkoxycarbonyloxy radicals fragment to form acyl and alkoxycarbonyl radicals? Beilstein journal of organic chemistry 20060101
Study of Burseraceae resins used in binding media and varnishes from artworks by gas chromatography-mass spectrometry and pyrolysis-gas chromatography-mass spectrometry. Journal of chromatography. A 20051104
Automated assay for the determination of methylmalonic acid, total homocysteine, and related amino acids in human serum or plasma by means of methylchloroformate derivatization and gas chromatography-mass spectrometry. Clinical chemistry 20051101
Mechanisms of solvolyses of acid chlorides and chloroformates. Chloroacetyl and phenylacetyl chloride as similarity models. The Journal of organic chemistry 20051028
A comparative study of several HPLC methods for determining free amino acid profiles in honey. Journal of separation science 20050601
Comparison of extraction methods for quantitation of methionine and selenomethionine in yeast by species specific isotope dilution gas chromatography-mass spectrometry. Journal of chromatography. A 20041105
Determination of methionine and selenomethionine in yeast by species-specific isotope dilution GC/MS. Analytical chemistry 20040901
An investigation of the N-demethylation of 3-deoxymorphine and the affinity of the alkylation products to mu, delta, and kappa receptors. Bioorganic & medicinal chemistry 20040515
Effect of a new beta-sitosterol analogue on plasma lipid concentrations in rats. Chemical & pharmaceutical bulletin 20040501
Solid-phase synthesis of 5-isoxazol-4-yl-[1,2,4]oxadiazoles. The Journal of organic chemistry 20040305
Two trace analytical methods for determination of hydroxylated PCBs and other halogenated phenolic compounds in eggs from Norwegian birds of prey. Analytical chemistry 20040115
Stereospecific Pd(0)-catalyzed arylation of an allylic hydroxy phosphonate derivative: formal synthesis of (S)-(+)-ar-turmerone. The Journal of organic chemistry 20031128
Simultaneous analysis of amino and nonamino organic acids as methyl chloroformate derivatives using gas chromatography-mass spectrometry. Analytical biochemistry 20031101
Comparison of different chloroformates for the derivatisation of seleno amino acids for gas chromatographic analysis. Journal of chromatography. A 20031010
New process for the preparation of methyl carbonates. Organic letters 20030501
Complex-induced proximity effects. Temperature-dependent regiochemical diversity in lithiation-electrophilic substitution reactions of N-BOC-2-azabicyclo[2.1.1]hexane. 2,4- and 3,5-methanoprolines. Organic letters 20020905
Analysis of carnitine biosynthesis metabolites in urine by HPLC-electrospray tandem mass spectrometry. Clinical chemistry 20020601
One pot synthesis of nitrogen-containing polycyclic delta-lactones by double nucleophilic addition of bis(trimethylsilyl)ketene acetals to pyridines. Chemical communications (Cambridge, England) 20020507
[[Intramolecular alkylation of aromatic compounds. 35. Di- and tetrahydropyridinemethylindolines as potential precursors of ergolines] ]. Die Pharmazie 20010101
Properties