4-Chloro-1-(3,4-dimethylphenyl)-1-butanone

Basic Information

4-Chloro-1-(3,4-dimethylphenyl)-1-butanone

CAS Number

74298-66-1

Molecular Formula

C12H15ClO

Molecular Weight

210.704 g/mol

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Basic Physical Properties

Melting Point

46-49 °C

Boiling Point

151-154 °C (1 mmHg)

Density

1.0589 (rough estimate)

Refractive Index

1.5300 (estimate)

SMILES

CC1=C(C=C(C=C1)C(=O)CCCCl)C

InChI

InChI=1S/C12H15ClO/c1-9-5-6-11(8-10(9)2)12(14)4-3-7-13/h5-6,8H,3-4,7H2,1-2H3

InChIKey

UMVFZGUNLWQTHV-UHFFFAOYSA-N

LogP

3.5051400000000026

Topological Polar Surface Area

17.07 Ų

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

191

Classification & Uses

Chemical Classification

Pharmaceutical Products
APIs & Intermediates
Intermediates

Safety Information

Synonyms & References

English

  • SCHEMBL5660140
  • NS00037611
  • DTXSID10225308
  • EINECS 277-806-6
  • 4-chloro-1-(3,4-dimethylphenyl)butan-1-one
  • NSC-163132
  • 4-CHLORO-1-(3,4-DIMETHYLPHENYL)-1-BUTANONE
  • FT-0641509
  • NSC163132
  • 4-Chloro-3',4'-dimethylbutyrophenone
  • 74298-66-1
  • NSC 163132
  • AKOS009157306
  • UMVFZGUNLWQTHV-UHFFFAOYSA-N
  • 4-chloro-1-(3,4-dimethylphenyl)-1-butanone
  • 4-Chlor-3',4'-dimethylbutyrophenon
  • 4-chloro-3',4'-dimethylbutyrophenone

CAS Number

74298-66-1

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