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Sodium hexanoate

Sodium hexanoate structure

CAS No:
10051-44-2
Formula:
C6H12O2.Na
Chemical Name:
Sodium hexanoate
Synonyms:
Hexanoic acid,sodium salt (1:1);Hexanoic acid,sodium salt;Sodium caproate;Sodium hexanoate;Sodium hexoate;Sodium capronate;Sodium n-caproate;Caproic acid sodium salt
Categories:
Analytical Chemistry > Food Safety

Description

ChEBI: An organic sodium salt resulting from the replacement of the proton from the carboxy group of hexanoic acid by a sodium ion.

Liquid

Sodium hexanoate is an organic sodium salt resulting from the replacement of the proton from the carboxy group of hexanoic acid by a sodium ion. It has a role as a human metabolite. It contains a hexanoate.

Sodium hexanoate Basic Attributes

Molecular Weight：

138.14

Exact Mass：

138.06600

EC Number：

233-179-0

UNII：

E00CG11S66

DSSTox ID：

DTXSID8064933

HScode：

2915900090

Characteristics

PSA：

40.1

XLogP3：

0.31660

Appearance：

White Powder

Melting Point：

225 °C

Boiling Point：

204.6ºC at 760mmHg

Flash Point：

90.3ºC

Storage Conditions：

2-8°C

Vapor Pressure：

0.158mmHg at 25°C

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36

Marks：

Precautionary statement(s)：

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

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

Bi(OHex)3

Sodium hexanoate Use and Manufacturing

Uses

Processing aids, not otherwise listed

Production

1,000,000 - 10,000,000 lb

Manufacturing Info：

Paper manufacturing|Hexanoic acid, sodium salt (1:1): ACTIVE

Computed Properties

Molecular Weight:138.14
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:138.06567387
Monoisotopic Mass:138.06567387
Topological Polar Surface Area:40.1
Heavy Atom Count:9
Complexity:73.5
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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N-CAPROIC ACID SODIUM SALT

CAS No.: 10051-44-2

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Sodium Hexanoate

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CAS No.: 10051-44-2

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