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Home > Encyclopedia > 1-(4-Chlorophenyl)-4,4-dimethyl-3-pentanone

1-(4-Chlorophenyl)-4,4-dimethyl-3-pentanone

1-(4-Chlorophenyl)-4,4-dimethyl-3-pentanone structure

1-(4-Chlorophenyl)-4,4-dimethyl-3-pentanone 

structure
  • CAS No:

    66346-01-8

  • Formula:

    C13H17ClO

  • Chemical Name:

    1-(4-Chlorophenyl)-4,4-dimethyl-3-pentanone

  • Synonyms:

    3-Pentanone,1-(4-chlorophenyl)-4,4-dimethyl-;1-(4-Chlorophenyl)-4,4-dimethyl-3-pentanone

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

Description

Liquid

1-(4-Chlorophenyl)-4,4-dimethyl-3-pentanone Basic Attributes

224.728

224.73

E3F88HO81Q

DTXSID7028300

2914700090

Characteristics

17.1

3.49

Liquid

1.1±0.1 g/cm3

18ºC

297.4±15.0 °C at 760 mmHg

178.9±11.5 °C

1.509

Store in a cool dry location, away from incompatible materials.

Safety Information

Stable at normal temperratures and pressures.

P264, P273, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, P362, P391, P501

H315

|Warning|H315 (27.05%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P273, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, P362, P391, and P501|Aggregated GHS information provided by 122 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

1-(4-Chlorophenyl)-4,4-dimethyl-3-pentanone Use and Manufacturing

Uses

Intermediates

Pesticide, fertilizer, and other agricultural chemical manufacturing|3-Pentanone, 1-(4-chlorophenyl)-4,4-dimethyl-: ACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Computed Properties

Molecular Weight:224.72
XLogP3:3.9
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:224.0967929
Monoisotopic Mass:224.0967929
Topological Polar Surface Area:17.1
Heavy Atom Count:15
Complexity:209
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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