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4-Ethyloctanoic acid

4-Ethyloctanoic acid structure

CAS No:
16493-80-4
Formula:
C10H20O2
Chemical Name:
4-Ethyloctanoic acid
Synonyms:
Octanoic acid,4-ethyl-;4-Ethyloctanoic acid
Categories:
Cosmetic Ingredient > Perfuming

Description

4-Ethyloctanoic acid is a natural compound first isolated from Saussurea lappa Clarke, widely used as a safe flavoring compound and acts as food additive[1].

Liquid; fruity, floral aroma

4-Ethyloctanoic acid is a medium-chain fatty acid.

4-Ethyloctanoic acid Basic Attributes

Molecular Weight：

172.26

Exact Mass：

172.26

EC Number：

240-560-5

HScode：

2915900090

Characteristics

PSA：

37.3

XLogP3：

3.6

Appearance：

Colorless Liquid

Density：

0.904

Boiling Point：

142-143 °C @ Press: 10 Torr

Flash Point：

212°F

Refractive Index：

1.439

Water Solubility：

Slightly soluble in water(0.13 mg/mL). Soluble in hexane

Vapor Pressure：

0.00178mmHg 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-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362|Aggregated GHS information provided by 1444 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

4-ethyloctanoic acid

4-Ethyloctanoic acid Use and Manufacturing

Uses

It can be used for the preparation of edible flavors.

Manufacturing Info：

Octanoic acid, 4-ethyl-: ACTIVE

Use Classification：

Food additives -> Flavoring Agents|Flavoring Agents -> JECFA Flavorings Index|Fatty Acyls [FA] -> Fatty Acids and Conjugates [FA01] -> Unsaturated fatty acids [FA0103]

Food Additive Classes：

Flavoring Agents

Computed Properties

Molecular Weight:172.26
XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:7
Exact Mass:172.146329876
Monoisotopic Mass:172.146329876
Topological Polar Surface Area:37.3
Heavy Atom Count:12
Complexity:121
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Recommended Suppliers of 4-Ethyloctanoic acid

LEADER BIOCHEMICAL GROUP Contact Supplier

CN
8 YRS

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China Professional Factory Manufacturer Supply Hight Quality 4-Ethyloctanoic Acid CAS 16493-80-4

CAS No.: 16493-80-4

Grade: Food Grade

Content: 99%

Inquiry
Greenbo Biochem Contact Supplier

CN
5 YRS

Business licensed Certified factory

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4-Ethyloctanoic acid 99% high purity certified Professional producer Greenbo

CAS No.: 16493-80-4

Grade: Food Grade

Content: 99%

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Guide of 4-Ethyloctanoic acid

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
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4-Ethyloctanoic acid

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