chempirical

4-Amino-4'-chlorodiphenyl

C12H10ClNCAS 135-68-2203.67 g/mol

Open in Covalent MOL file
H2NCl
Aryl halidePrimary amine

Properties

Molecular formula
C12H10ClN
Molar mass
203.67 g/mol
Exact mass
203.0502 Da
Melting point
134 °C
logP
3.59Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

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
135-68-2
SMILES
Nc1ccc(-c2ccc(Cl)cc2)cc1
InChIKey
OREQWMWYRYXCDF-UHFFFAOYSA-N
InChI
InChI=1S/C12H10ClN/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-8H,14H2

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Names and synonyms

15 names · show all
  • 4′-Chloro[1,1′-biphenyl]-4-amine
  • [1,1′-Biphenyl]-4-amine, 4′-chloro-
  • 4-Biphenylamine, 4′-chloro-
  • p-Amino-p′-chlorobiphenyl
  • 4-Amino-4′-chlorobiphenyl
  • 4-Amino-4′-chlorodiphenyl
  • p′-Chloro-p-phenylaniline
  • 4′-Chloro-4-aminobiphenyl
  • 4′-Chloro-4-biphenylamine
  • 4-Chloro-4′-aminobiphenyl
  • NSC 95713
  • (4′-Chlorobiphenyl-4-yl)amine
  • 4-(4-Chlorophenyl)aniline
  • 4′-Chloro-[1,1′-biphenyl]-4-amine
  • 4-Amino-4′-chloro-1,1′-biphenyl

Work with 4-Amino-4'-chlorodiphenyl

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-Chloroaniline106-47-883 % similar 4-Chloroaniline hydrochloride20265-96-771 % similar 4,4′-Dichlorobiphenyl2050-68-267 % similar 4,4''-Diaminoterphenyl3365-85-367 % similar Benzidine92-87-567 % similar 4-(4-Chlorophenoxy)benzenamine101-79-163 % similar 1,3,5-Tri(4-aminophenyl)benzene118727-34-757 % similar [1,1′-Biphenyl]-4,4′-diamine hydrochloride (1:2)531-85-157 % similar

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

Same formula

3-Chlorodiphenylamine101-17-7 2-Amino-4'-chlorobiphenyl1204-44-0 4-Chloro-N-phenylaniline1205-71-6 2-[(4-Chlorophenyl)methyl]pyridine4350-41-8

Elsewhere

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