(+)-3-Chloro-1,2-propanediol

C₃H₇ClO₂CAS 60827-45-4110.54 g/mol

Open in Covalent MOL file

Alcohol Halogen

Properties

Molecular formula: C₃H₇ClO₂
Molar mass: 110.54 g/mol
Exact mass: 110.0135 Da
logP: -0.42Crippen estimate
Polar surface area: 40.5 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 2

Identifiers

CAS number

60827-45-4

SMILES

OC[C@H](O)CCl

InChIKey

SSZWWUDQMAHNAQ-GSVOUGTGSA-N

InChI

InChI=1S/C3H7ClO2/c4-1-3(6)2-5/h3,5-6H,1-2H2/t3-/m1/s1

Weigh it out

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

Names and synonyms

10 names

1,2-Propanediol, 3-chloro-, (2S)-
1,2-Propanediol, 3-chloro-, (S)-
(2S)-3-Chloro-1,2-propanediol
S-(+)-α-Chlorohydrin
(S)-3-Chloro-1,2-propanediol
(S)-α-Chlorohydrin
(S)-(+)-3-Chloro-1,2-propanediol
(S)-Monochlorohydrin
(2S)-3-Chloropropane-1,2-diol
1,2-Propanediol 3-chloro-, (2S)-

Work with (+)-3-Chloro-1,2-propanediol

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

Same formula

(2R)-3-Chloro-1,2-propanediol57090-45-6 3-Mcpd96-24-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook