Home Other Building Blocks Phenylacetyl chloride

Phenylacetyl chloride

CAS No.:
103-80-0
Catalog Number:
AG0035H1
Molecular Formula:
C8H7ClO
Molecular Weight:
154.5936
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
In Stock USA
United States
$13
- +
Product Description
Catalog Number:
AG0035H1
Chemical Name:
Phenylacetyl chloride
CAS Number:
103-80-0
Molecular Formula:
C8H7ClO
Molecular Weight:
154.5936
MDL Number:
MFCD00000729
IUPAC Name:
2-phenylacetyl chloride
InChI:
InChI=1S/C8H7ClO/c9-8(10)6-7-4-2-1-3-5-7/h1-5H,6H2
InChI Key:
VMZCDNSFRSVYKQ-UHFFFAOYSA-N
SMILES:
ClC(=O)Cc1ccccc1
EC Number:
203-146-5
UNII:
T30899DRND
UN Number:
2577
Properties
Complexity:
116  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.019g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.593g/mol
Monoisotopic Mass:
154.019g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Literature
Title Journal
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
Practical synthesis of hydroxychromenes and evaluation of their biological activity. Molecules (Basel, Switzerland) 20111228
Biocatalytic organic synthesis of optically pure (S)-scoulerine and berbine and benzylisoquinoline alkaloids. The Journal of organic chemistry 20110819
Design, synthesis and biological evaluation of new 5,5-diarylhydantoin derivatives as selective cyclooxygenase-2 inhibitors. Scientia pharmaceutica 20110101
Penicillin Acylase-Catalyzed Effective and Stereoselective Acylation of 1-phenylethylamine in Aqueous Medium using Non-Activated Acyl Donor. Acta naturae 20100401
Synthesis, characterization and potential application of monoacyl-cyclodextrins. Carbohydrate research 20100126
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
Synthesis and evaluation of 1-(1-(Benzo[b]thiophen-2-yl)cyclohexyl)piperidine (BTCP) analogues as inhibitors of trypanothione reductase. ChemMedChem 20090803
Grunwald-Winstein analysis: isopropyl chloroformate solvolysis revisited. International journal of molecular sciences 20090301
3-Benzyl-isochroman-1-one. Acta crystallographica. Section E, Structure reports online 20090301
N,N-Diethyl-N'-phenyl-acetyl-thio-urea. Acta crystallographica. Section E, Structure reports online 20081201
Extended Grunwald-Winstein analysis - LFER used to gauge solvent effects in p-nitrophenyl chloroformate solvolysis. International journal of molecular sciences 20081101
Synthesis and Pharmacological Evaluation of Azetidin-2-ones and Thiazolidin-4-ones Encompassing Benzothiazole. Indian journal of pharmaceutical sciences 20080101
A study on 4-acylamino-4,5-dihydro-1H-1,2,4-triazol-5-ones. Molecules (Basel, Switzerland) 20070813
Mechanisms of solvolyses of acid chlorides and chloroformates. Chloroacetyl and phenylacetyl chloride as similarity models. The Journal of organic chemistry 20051028
Synthesis and antimicrobial activity of some new sugar-based monocyclic beta-lactams. Molecules (Basel, Switzerland) 20040131
Properties