chempirical

(R)-(+)-3-Chlorostyrene oxide

C8H7ClOCAS 62600-71-9154.59 g/mol

Open in Covalent MOL file
OCl
Aryl halideEpoxideEther

Properties

Molecular formula
C8H7ClO
Molar mass
154.59 g/mol
Exact mass
154.0185 Da
logP
2.41Crippen estimate
Polar surface area
12.5 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1
Stereocentres
Rin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
62600-71-9
SMILES
C1[C@H](O1)C2=CC(=CC=C2)Cl
InChIKey
YVMKRPGFBQGEBF-QMMMGPOBSA-N
InChI
InChI=1S/C8H7ClO/c9-7-3-1-2-6(4-7)8-5-10-8/h1-4,8H,5H2/t8-/m0/s1

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Names and synonyms

1 names
  • (R)-3-Chlorostyrene oxide

Work with (R)-(+)-3-Chlorostyrene oxide

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

(+)-Styrene oxide20780-53-456 % similar (S)-Styrene oxide20780-54-556 % similar Styrene oxide96-09-356 % similar (βS)-β-Amino-3-chlorobenzeneethanol663611-73-246 % similar (2S)-2-(3,4-Difluorophenyl)oxirane1006376-63-145 % similar (1R)-1-(3-Chlorophenyl)ethanol120121-01-945 % similar (1S)-1-(3-Chlorophenyl)ethan-1-ol135145-34-545 % similar 3-Chlorobenzhydrol63012-03-345 % similar

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

Same formula

Phenylacetyl chloride103-80-0 2-Chloro-6-methylbenzaldehyde1194-64-5 3-Methylbenzoyl chloride1711-06-4 2′-Chloroacetophenone2142-68-9 4-Chlorostyrene oxide2788-86-5 3-Chloro-4-methylbenzaldehyde3411-03-8 4-Chloro-2-methylbenzaldehyde40137-29-9 Phenacyl chloride532-27-4

Elsewhere

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