Isobutyl (R)-2-hydroxypropionate

C₇H₁₄O₃CAS 61597-96-4146.19 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₇H₁₄O₃
Molar mass: 146.19 g/mol
Exact mass: 146.0943 Da
logP: 0.57Crippen estimate
Polar surface area: 46.5 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 3
Stereocentres: Rin SMILES atom order

Identifiers

CAS number

61597-96-4

SMILES

CC(C)COC(=O)[C@@H](C)O

InChIKey

WBPAQKQBUKYCJS-ZCFIWIBFSA-N

InChI

InChI=1S/C7H14O3/c1-5(2)4-10-7(9)6(3)8/h5-6,8H,4H2,1-3H3/t6-/m1/s1

Weigh it out

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

Names and synonyms

10 names

Propanoic acid, 2-hydroxy-, 2-methylpropyl ester, (2R)-
Propanoic acid, 2-hydroxy-, 2-methylpropyl ester, (R)-
(R)-(+)-Isobutyl lactate
Isobutyl (R)-lactate
(R)-Lactic acid isobutyl ester
(R)-(+)-Lactic acid isobutyl ester
D-Isobutyl lactate
(+)-Isobutyl lactate
(+)-Isobutyl D-lactate
2-Methylpropyl (2R)-2-hydroxypropanoate

Work with Isobutyl (R)-2-hydroxypropionate

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

Isoamyl lactate19329-89-667 % similar Propyl (2S)-2-hydroxypropanoate53651-69-763 % similar Propyl lactate616-09-163 % similar Ethyl lactate687-47-862 % similar Ethyl lactate97-64-362 % similar Isobutyl isobutyrate97-85-861 % similar Lactic anhydride97-73-456 % similar Isobutyl L-(-)-2-chloropropionate83261-15-855 % similar

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

Same formula

Glycidaldehyde diethyl acetal13269-77-7 N-Butyl lactate138-22-7 Methyl 3-hydroxyhexanoate21188-58-9 Tetrahydrofurfuryl polyethylene glycol31692-85-0 Butyl (2S)-2-hydroxypropanoate34451-19-9 3-Methoxybutyl acetate4435-53-4 6-Hydroxyhexanoic acid methyl ester4547-43-7 [2,2-Dimethyl-1,3-dioxan-5-yl)methanol4728-12-5

Elsewhere

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