4-Phenylbenzyl chloride

C13H11ClCAS 1667-11-4202.68 g/mol

Open in Covalent MOL file
Cl
Alkyl halide

Properties

Molecular formula
C13H11Cl
Molar mass
202.68 g/mol
Exact mass
202.0549 Da
Melting point
68 °C
Boiling point
130 °C (at 0.3 Torr)
logP
4.09Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
1667-11-4
SMILES
ClCc1ccc(-c2ccccc2)cc1
InChIKey
HLQZCRVEEQKNMS-UHFFFAOYSA-N
InChI
InChI=1S/C13H11Cl/c14-10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9H,10H2

Weigh it out

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

Names and synonyms

9 names
  • 1,1′-Biphenyl, 4-(chloromethyl)-
  • Biphenyl, 4-(chloromethyl)-
  • 4-(Chloromethyl)-1,1′-biphenyl
  • p-Phenylbenzyl chloride
  • 4CMB
  • 4-(Chloromethyl)biphenyl
  • 1-(Chloromethyl)-4-phenylbenzene
  • NSC 16277
  • (1,1′-Biphenyl-4-yl)methyl chloride

Work with 4-Phenylbenzyl chloride

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

4,4′-Bis(chloromethyl)biphenyl1667-10-379 % similar Benzyl chloride100-44-770 % similar Alpha,alpha'-Dichloro-p-xylene623-25-663 % similar P-Benzylbiphenyl613-42-357 % similar para-Quaterphenyl135-70-653 % similar P-Quinquephenyl3073-05-053 % similar 1,1′:4′,1′′:4′′,1′′′:4′′′,1′′′′:4′′′′,1′′′′′-Sexiphenyl4499-83-653 % similar Terphenyl92-94-453 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(4-Chlorophenyl)phenylmethane831-81-2 Chlorodiphenylmethane90-99-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook