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Hexanoic acid, 5-oxo-, ethyl ester

Hexanoic acid, 5-oxo-, ethyl ester structure

CAS No:
13984-57-1
Formula:
C8H14O3
Chemical Name:
Hexanoic acid, 5-oxo-, ethyl ester
Synonyms:
Hexanoic acid,5-oxo-,ethyl ester;Ethyl 5-oxohexanoate;5-Oxohexanoic acid ethyl ester;Ethyl 5-oxocaproate;4-Acetylbutyric acid ethyl ester;Ethyl 4-acetylbutyrate
Categories:
Catalyst and Auxiliary > Plastic Rubber Chemicals

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Hexanoic acid, 5-oxo-, ethyl ester Basic Attributes

Molecular Weight：

158.19

Exact Mass：

158.20

BRN：

1762625

EC Number：

237-776-7

UNII：

DJ9EME6QBQ

DSSTox ID：

DTXSID6065688

HScode：

2918300090

Characteristics

PSA：

43.4

XLogP3：

0.86

Density：

0.9971 g/cm³ @ Temp: 20 °C

Boiling Point：

221.5 °C

Flash Point：

157 °F

Refractive Index：

n 20/D 1.427(lit.)

Vapor Pressure：

0.103mmHg at 25°C

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

safety instructions：

24/25

Marks：

GHS Classification：

|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|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hexanoic acid, 5-oxo-, ethyl ester Use and Manufacturing

Manufacturing Info：

Hexanoic acid, 5-oxo-, ethyl ester: INACTIVE

Computed Properties

Molecular Weight:158.19
XLogP3:0.4
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:158.094294304
Monoisotopic Mass:158.094294304
Topological Polar Surface Area:43.4
Heavy Atom Count:11
Complexity:140
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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ETHYL 4-ACETYLBUTYRATE

CAS No.: 13984-57-1

Content: 99.00%

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Guide of Hexanoic acid, 5-oxo-, ethyl ester

Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
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Hexanoic acid, 5-oxo-, ethyl ester

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