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Butanoic acid, 4-chloro-, methyl ester

Butanoic acid, 4-chloro-, methyl ester structure

CAS No:
3153-37-5
Formula:
C5H9ClO2
Chemical Name:
Butanoic acid, 4-chloro-, methyl ester
Synonyms:
Butanoic acid,4-chloro-,methyl ester;Butyric acid,4-chloro-,methyl ester;Methyl 4-chlorobutyrate;Methyl 4-chlorobutanoate;γ-Chlorobutyric acid methyl ester;Methyl ω-chlorobutyrate;4-Chlorobutyric acid methyl ester;Methyl γ-chlorobutyrate;4-Chlorobutanoic acid methyl ester;NSC 66271
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Description

clear colourless liquid

Butanoic acid, 4-chloro-, methyl ester Basic Attributes

Molecular Weight：

136.58

Exact Mass：

136.58

BRN：

1745117

EC Number：

221-592-9

NSC Number：

66271

DSSTox ID：

DTXSID7062873

HScode：

29159080

Characteristics

PSA：

26.3

XLogP3：

1.16

Appearance：

Clear colorless Liquid

Density：

1.11624 g/cm³ @ Temp: 25.00 °C

Boiling Point：

175 °C

Flash Point：

139 °F

Refractive Index：

1.420

Water Solubility：

Slightly soluble in water.

Safety Information

Packing level：

III

Hazard category：

Transport codes：

UN 3272 3/PG 3

wgk germany：

hazard class code：

36/37/38

safety instructions：

37/39-26

Marks：

Precautionary statement(s)：

P210, P233, P240, P241, P242, P243, P261, P264, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P370+P378, P403+P233, P403+P235, P405, P501

Hazard Statements：

H226

GHS Classification：

|Warning|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P261, P264, P271, P280, P302+P352, P303+P361+P353, 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 45 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Butanoic acid, 4-chloro-, methyl ester Use and Manufacturing

Uses

Used in the synthesis of cyclopropylamine, etc.

Manufacturing Info：

Butanoic acid, 4-chloro-, methyl ester: ACTIVE

Computed Properties

Molecular Weight:136.58
XLogP3:1.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:136.0291072
Monoisotopic Mass:136.0291072
Topological Polar Surface Area:26.3
Heavy Atom Count:8
Complexity:72.8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Butanoic acid, 4-chloro-, methyl ester

Description
Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
Latest News
Learn More Other Chemicals

Butanoic acid, 4-chloro-, methyl ester

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