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Home > Encyclopedia > Acetic acid, 2-chloro-, 3-methylbutyl ester

Acetic acid, 2-chloro-, 3-methylbutyl ester

Acetic acid, 2-chloro-, 3-methylbutyl ester structure

Acetic acid, 2-chloro-, 3-methylbutyl ester 

structure
  • CAS No:

    5326-92-1

  • Formula:

    C7H13ClO2

  • Chemical Name:

    Acetic acid, 2-chloro-, 3-methylbutyl ester

  • Synonyms:

    Acetic acid,2-chloro-,3-methylbutyl ester;Acetic acid,chloro-,3-methylbutyl ester;Acetic acid,chloro-,isopentyl ester;3-Methylbutyl monochloroacetate;Isopentyl chloroacetate;Isoamyl chloroacetate;NSC 4085;3-Methylbutyl 2-chloroacetate

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

Acetic acid, 2-chloro-, 3-methylbutyl ester Basic Attributes

164.63000

164.63

226-207-8

4085

2915400090

Characteristics

26.30000

1.81450

1.033g/cm3

194-196 °C @ Press: 649.997 Torr

74.5ºC

1.428

Safety Information

P264, P280, P305+P351+P338, P33, P313

H319

|Warning|H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]|P264, P280, P305+P351+P338, and P337+P313|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:164.63
XLogP3:2.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:164.0604073
Monoisotopic Mass:164.0604073
Topological Polar Surface Area:26.3
Heavy Atom Count:10
Complexity:102
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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