(S)-(-)-2-Methoxypropionic acid

C₄H₈O₃CAS 23953-00-6104.10 g/mol

Open in Covalent MOL file

Carboxylic acid Ether

Properties

Molecular formula: C₄H₈O₃
Molar mass: 104.10 g/mol
Exact mass: 104.0473 Da
logP: 0.11Crippen estimate
Polar surface area: 46.5 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 2
Stereocentres: Sin SMILES atom order

Identifiers

CAS number

23953-00-6

SMILES

C[C@@H](C(=O)O)OC

InChIKey

ICPWFHKNYYRBSZ-VKHMYHEASA-N

InChI

InChI=1S/C4H8O3/c1-3(7-2)4(5)6/h3H,1-2H3,(H,5,6)/t3-/m0/s1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

2-Methoxypropanoic acid, (S)-

Work with (S)-(-)-2-Methoxypropionic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

(2S)-2-(Acetyloxy)propanoic acid6034-46-454 % similar (2S,3S)-2-Amino-3-methoxybutanoic acid104195-80-450 % similar 2-(4-Methoxyphenoxy)propionic acid13794-15-548 % similar Dl-2-phenoxypropionic acid940-31-847 % similar Methylmalonic acid516-05-246 % similar Isobutyric acid79-31-246 % similar 2-(4-Hydroxyphenoxy)propionic acid67648-61-745 % similar (2R)-2-(4-Hydroxyphenoxy)propanoic acid94050-90-545 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

(+)-Methyl lactate17392-83-5 (-)-Methyl lactate27871-49-4 Beta-hydroxybutyric acid300-85-6 (S)-2-Hydroxybutyric acid3347-90-8 Erythritan4358-64-9 1,3-Dioxan-5-ol4740-78-7 2,2-Dimethoxyacetaldehyde51673-84-8 Glycol monoacetate542-59-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook