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Propyl pentanoate

Propyl pentanoate structure

CAS No:
141-06-0
Formula:
C8H16O2
Chemical Name:
Propyl pentanoate
Synonyms:
Pentanoic acid,propyl ester;Valeric acid,propyl ester;n-Propyl n-valerate;Propyl pentanoate;Propyl valerate;NSC 57638;116423-68-8
Categories:
Cosmetic Ingredient > Perfuming

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Description

Liquid

Propyl pentanoate is a fatty acid ester.

Propyl pentanoate Basic Attributes

Molecular Weight：

144.21100

Exact Mass：

144.21

EC Number：

205-452-4

UNII：

28688DWX24

NSC Number：

57638

DSSTox ID：

DTXSID90161513

HScode：

2915600000

Characteristics

PSA：

26.30000

XLogP3：

2.12980

Appearance：

Liquid

Density：

0.878g/cm3

Melting Point：

-70.7 °C

Boiling Point：

167.5 °C

Flash Point：

52.4ºC

Refractive Index：

n20/D 1.407

Water Solubility：

308.7 mg/L @ 25 °C (est)

Vapor Pressure：

1.6mmHg at 25°C

Safety Information

Transport codes：

UN 1993 3/PG 3

hazard class code：

safety instructions：

Precautionary statement(s)：

P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, P501

Hazard Statements：

H226

GHS Classification：

|Warning|H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]|P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501|Aggregated GHS information provided by 40 companies from 1 notifications to the ECHA C&L Inventory.

Propyl pentanoate Use and Manufacturing

Use Classification：

Food additives -> Flavoring Agents|Fatty Acyls [FA] -> Fatty esters [FA07] -> Wax monoesters [FA0701]

Food Additive Classes：

Flavoring Agents

Computed Properties

Molecular Weight:144.21
XLogP3:2.4
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:6
Exact Mass:144.115029749
Monoisotopic Mass:144.115029749
Topological Polar Surface Area:26.3
Heavy Atom Count:10
Complexity:89.3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Propyl pentanoate

Description
Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Learn More Other Chemicals

Propyl pentanoate

SDS

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