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Home > Encyclopedia > 4-Chlorochalcone

4-Chlorochalcone

4-Chlorochalcone structure

4-Chlorochalcone 

structure
  • CAS No:

    956-04-7

  • Formula:

    C15H11ClO

  • Chemical Name:

    4-Chlorochalcone

  • Synonyms:

    2-Propen-1-one,3-(4-chlorophenyl)-1-phenyl-;Chalcone,4-chloro-;3-(4-Chlorophenyl)-1-phenyl-2-propen-1-one;4-Chlorochalcone;2-(4-Chlorobenzylidene)acetophenone;p-Chlorostyryl phenyl ketone;p-Chlorochalcone;1-Phenyl-3-(4-chlorophenyl)prop-2-en-1-one;(4-Chlorobenzylidene)acetophenone;3-(p-Chlorophenyl)-1-phenyl-2-propen-1-one;4-Chlorostyryl phenyl ketone;NSC 2643;NSC 636920;1-Phenyl-3-(4-chlorophenyl)-2-propenone;139556-81-3

Description

ChEBI: A member of the class of chalcones that is trans-chalcone substituted by a chloro group at position 4.

4-Chlorochalcone Basic Attributes

242.7

242.70

1105953

213-476-1

2914700090

Characteristics

17.1

4.23610

1.202 g/cm3

115-116 °C

345.7°C (rough estimate)

210.3ºC

1.632

Safety Information

NONH for all modes of transport

3

36/37/38

26-36/37/39

UD5572994

Xi

Irritant

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

H315

Computed Properties

Molecular Weight:242.70
XLogP3:3.7
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:242.0498427
Monoisotopic Mass:242.0498427
Topological Polar Surface Area:17.1
Heavy Atom Count:17
Complexity:271
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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