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Home > Encyclopedia > 1-(4-Chlorophenyl)-1-pentanone

1-(4-Chlorophenyl)-1-pentanone

1-(4-Chlorophenyl)-1-pentanone structure

1-(4-Chlorophenyl)-1-pentanone 

structure
  • CAS No:

    25017-08-7

  • Formula:

    C11H13ClO

  • Chemical Name:

    1-(4-Chlorophenyl)-1-pentanone

  • Synonyms:

    1-Pentanone,1-(4-chlorophenyl)-;Valerophenone,4′-chloro-;1-(4-Chlorophenyl)-1-pentanone;p-Chlorovalerophenone;4′-Chlorovalerophenone;4-Chlorophenyl butyl ketone;NSC 76591;1-(4-Chlorophenyl)pentan-1-one

  • Categories:

    Active Pharmaceutical Ingredients  >  Other Chemical Drugs

Description

white to yellow crystalline low melting solid

1-(4-Chlorophenyl)-1-pentanone Basic Attributes

196.67

196.67

246-566-4

S62TTW9MS5

76591

DTXSID70179717

2914700090

Characteristics

17.1

3.6

white solid

1.1±0.1 g/cm3

166-167 °C

140 °C @ Press: 12 Torr

30 °C

1.516

Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.

0.002mmHg at 25°C

Safety Information

3077

36/37/38

37/39-26-24/25

Xi

Stable under normal temperatures and pressures.

P261, P264, P270, P272, P280, P301+P312, P302+P352, P321, P330, P333+P313, P363, P501

H302

|Warning|H302 (90.48%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P272, P280, P301+P312, P302+P352, P321, P330, P333+P313, P363, and P501|Aggregated GHS information provided by 42 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:196.67
XLogP3:3.6
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:196.0654927
Monoisotopic Mass:196.0654927
Topological Polar Surface Area:17.1
Heavy Atom Count:13
Complexity:160
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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