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Home > Encyclopedia > 3-(4-CHLORO-PHENYL)-3-OXO-PROPIONICACIDETHYLESTER

3-(4-CHLORO-PHENYL)-3-OXO-PROPIONICACIDETHYLESTER

3-(4-CHLORO-PHENYL)-3-OXO-PROPIONICACIDETHYLESTER structure

3-(4-CHLORO-PHENYL)-3-OXO-PROPIONICACIDETHYLESTER 

structure
  • CAS No:

    2881-63-2

  • Formula:

    C11H11ClO3

  • Chemical Name:

    3-(4-CHLORO-PHENYL)-3-OXO-PROPIONICACIDETHYLESTER

  • Synonyms:

    NSC406743;ETHYL(4-CHLOROBENZOYL)ACETATE;ETHYL3-(4-CHLOROPHENYL)-3-OXOPROPANOATE;Ethyl3-(4-chlorophenyl)-3-oxo-propionate;3-(4-Chlorophenyl)-3-oxopropanoicacidethylester;3-(4-chlorophenyl)-3-keto-propionicacidethylester;3-(4-CHLORO-PHENYL)-3-OXO-PROPIONICACIDETHYLESTER

  • Categories:

    Pharmaceutical Intermediates  >  Heterocyclic Compound

3-(4-CHLORO-PHENYL)-3-OXO-PROPIONICACIDETHYLESTER Basic Attributes

226.66

226.039673

406743

DTXSID20183001

2918300090

Characteristics

43.4

2.5

1.2±0.1 g/cm3

38 °C(Solv: ethanol (64-17-5))

314.1°C at 760 mmHg

128.2±19.9 °C

1.524

0.000476mmHg at 25°C

Safety Information

NONH for all modes of transport

3

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, P501

H302

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

AC 413

Computed Properties

Molecular Weight:226.65
XLogP3:2.5
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:226.0396719
Monoisotopic Mass:226.0396719
Topological Polar Surface Area:43.4
Heavy Atom Count:15
Complexity:232
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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