Home Other Building Blocks 2-Hydroxy-2-methylbutyric acid

2-Hydroxy-2-methylbutyric acid

CAS No.:
3739-30-8
Catalog Number:
AG0033C5
Molecular Formula:
C5H10O3
Molecular Weight:
118.1311
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$27
- +
5g
95%
In Stock USA
United States
$59
- +
10g
95%
In Stock USA
United States
$105
- +
Product Description
Catalog Number:
AG0033C5
Chemical Name:
2-Hydroxy-2-methylbutyric acid
CAS Number:
3739-30-8
Molecular Formula:
C5H10O3
Molecular Weight:
118.1311
MDL Number:
MFCD00004476
IUPAC Name:
2-hydroxy-2-methylbutanoic acid
InChI:
InChI=1S/C5H10O3/c1-3-5(2,8)4(6)7/h8H,3H2,1-2H3,(H,6,7)
InChI Key:
MBIQENSCDNJOIY-UHFFFAOYSA-N
SMILES:
CC(C(=O)O)(CC)O
EC Number:
223-120-7
NSC Number:
9458
Properties
Complexity:
99.8  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
118.063g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
118.132g/mol
Monoisotopic Mass:
118.063g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Literature
Title Journal
Separation and analysis of lanthanides by isotachophoresis coupled with inductively coupled plasma mass spectrometry. Talanta 20120915
Modular Chemical Descriptor Language (MCDL): Stereochemical modules. Journal of cheminformatics 20110101
Liver Metabolic Alterations and Changes in Host Intercompartmental Metabolic Correlation during Progression of Malaria. Journal of parasitology research 20110101
Alterations in urine, serum and brain metabolomic profiles exhibit sexual dimorphism during malaria disease progression. Malaria journal 20100101
Derivatization of guar to sodium carboxy methyl hydroxy propyl derivative; characterization and evaluation. Pakistan journal of pharmaceutical sciences 20080101
Absolute configuration of the creatonotines and callimorphines, two classes of arctiid-specific pyrrolizidine alkaloids. Insect biochemistry and molecular biology 20070101
Stereoselective biocatalytic synthesis of (S)-2-hydroxy-2-methylbutyric acid via substrate engineering by using 'thio-disguised' precursors and oxynitrilase catalysis. Chemistry (Weinheim an der Bergstrasse, Germany) 20070101
Fluorescence spectroscopy of jet-cooled chiral (+/-)-indan-1-ol and its cluster with (+/-)-methyl- and ethyl-lactate. The Journal of chemical physics 20061107
Generation of roasted notes based on 2-acetyl-2-thiazoline and its precursor, 2-(1-hydroxyethyl)-4,5-dihydrothiazole, by combined bio and thermal approaches. Journal of agricultural and food chemistry 20020410
Biotransformation of MTBE, ETBE, and TAME after inhalation or ingestion in rats and humans. Research report (Health Effects Institute) 20010501
Properties