3-Chlorophenyl ethyl ketone[3-氯苯乙基酮]

34841-35-5

CAS Name

1-(3-Chlorophenyl)-1-propanone

Molecular Formula

C₉H₉ClO

Molecular Mass

168.62

Compound Properties

• Boiling Point (1)

  135-137 °C @ Press: 1 Torr

• Melting Point (2)

  45-46 °C

Source(s)

• (1) Pellegrini, Maria J. Taglianetti; Anais fac. farm. e odontol. univ. São Paulo, (1954), 12, 13-16, CAplus
• (2) Zenitz, Bernard L.; Journal of Organic Chemistry, (1946), 11, 444-53, CAplus

Other Names and Identifiers

InChI

InChI=1S/C9H9ClO/c1-2-9(11)7-4-3-5-8(10)6-7/h3-6H,2H2,1H3

InChIKey

InChIKey=PQWGFUFROKIJBO-UHFFFAOYSA-N

SMILES

C(CC)(=O)C1=CC(Cl)=CC=C1

Canonical SMILES

O=C(C=1C=CC=C(Cl)C1)CC

Other Names for this Substance