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Home > Encyclopedia > Butanoic acid, 2-chloro-3-oxo-, 1,1-diMethylethyl ester

Butanoic acid, 2-chloro-3-oxo-, 1,1-diMethylethyl ester

Butanoic acid, 2-chloro-3-oxo-, 1,1-diMethylethyl ester structure

Butanoic acid, 2-chloro-3-oxo-, 1,1-diMethylethyl ester 

structure
  • CAS No:

    7304-72-5

  • Formula:

    C8H13ClO3

  • Chemical Name:

    Butanoic acid, 2-chloro-3-oxo-, 1,1-diMethylethyl ester

  • Synonyms:

    tert-Butyl 2-chloro-3-oxobutanoate;Butanoic acid, 2-chloro-3-oxo-, 1,1-dimethylethyl ester;SCHEMBL3827638;CTK2H1800;DTXSID80540479;2-Chloroacetoacetic acid tert-butyl ester

Butanoic acid, 2-chloro-3-oxo-, 1,1-diMethylethyl ester Basic Attributes

192.64002

192.055

DTXSID80540479

Characteristics

43.4

1.7

Safety Information

|Warning|H227 (100%): Combustible liquid [Warning Flammable liquids]|P210, P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, and P501|Aggregated GHS information provided by 2 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:192.64
XLogP3:1.7
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:192.0553220
Monoisotopic Mass:192.0553220
Topological Polar Surface Area:43.4
Heavy Atom Count:12
Complexity:193
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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