chempirical

2-Chlorostyrene

C8H7ClCAS 2039-87-4138.59 g/mol

Open in Covalent MOL file
Cl
AlkeneAryl halide

Properties

Molecular formula
C8H7Cl
Molar mass
138.59 g/mol
Exact mass
138.0236 Da
Density
1.1 g/mL (at 20 °C)
Melting point
−63.1 °C
Boiling point
188.7 °C
logP
2.98Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
1

Identifiers

CAS number
2039-87-4
SMILES
C=Cc1ccccc1Cl
InChIKey
ISRGONDNXBCDBM-UHFFFAOYSA-N
InChI
InChI=1S/C8H7Cl/c1-2-7-5-3-4-6-8(7)9/h2-6H,1H2

Weigh it out

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

Names and synonyms

8 names
  • Benzene, 1-chloro-2-ethenyl-
  • Styrene, o-chloro-
  • 1-Chloro-2-ethenylbenzene
  • o-Chlorostyrene
  • o-Chlorovinylbenzene
  • NSC 18601
  • 1-Chloro-2-vinylbenzene
  • o-Chlorosytrene

Work with 2-Chlorostyrene

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,6-Dichlorostyrene28469-92-358 % similar 2-Chlorobenzaldehyde89-98-554 % similar 1-Vinylnaphthalene826-74-452 % similar 2-Bromostyrene2039-88-550 % similar 2-Methylstyrene611-15-450 % similar 2-Chlorobenzaldehyde oxime3717-28-048 % similar 1-Ethenyl-2-fluorobenzene394-46-748 % similar 1,2-Dichlorobenzene95-50-148 % similar

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

Same formula

4-Chlorostyrene1073-67-2 3-Chlorostyrene2039-85-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia