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Citronellyl valerate

Citronellyl valerate structure

CAS No:
7540-53-6
Formula:
C15H28O2
Chemical Name:
Citronellyl valerate
Synonyms:
Pentanoic acid,3,7-dimethyl-6-octen-1-yl ester;Valeric acid,3,7-dimethyl-6-octen-1-yl ester;Pentanoic acid,3,7-dimethyl-6-octenyl ester;6-Octen-1-ol,3,7-dimethyl-,valerate;Citronellyl valerate;Citronellyl pentanoate;Citronellol valerate;Citronellol pentanoate;n-Citronellyl valerate;76444-26-3
Categories:
Flavors and Fragrances > Synthetic Fragrances

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Description

Citronellyl valerate has a characteristic rose-, herb-, honey-like odor.

liquid/rose, herb, honey-like odour

Citronellyl pentanoate is a carboxylic ester.

Citronellyl valerate Basic Attributes

Molecular Weight：

240.38

Exact Mass：

240.38

EC Number：

231-416-2

Characteristics

PSA：

26.30000

XLogP3：

4.49240

Appearance：

liquid/rose, herb, honey-like odour

Density：

0.88 g/mL at 25ºC(lit.)

Boiling Point：

237 °C(lit.)

Flash Point：

>230 °F

Refractive Index：

n20/D 1.445(lit.)

Water Solubility：

0.1879 mg/L @ 25 °C (est)

Safety Information

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36

Marks：

Precautionary statement(s)：

P261, P264, P271, P273, 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, P273, 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 126 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Citronellyl valerate Use and Manufacturing

Uses

Spices for food. Used in the preparation of spices, honey and other flavors.

Manufacturing Info：

Pentanoic acid, 3,7-dimethyl-6-octen-1-yl ester: ACTIVE

Use Classification：

Food additives -> Flavoring Agents|Flavouring Agent -> FLAVOURING_AGENT; -> JECFA Functional Classes|Flavoring Agents -> JECFA Flavorings Index|Fatty Acyls [FA] -> Fatty esters [FA07] -> Wax monoesters [FA0701]

Food Additive Classes：

Flavoring Agents|Flavouring Agent -> FLAVOURING_AGENT;

Computed Properties

Molecular Weight:240.38
XLogP3:5.1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:10
Exact Mass:240.208930132
Monoisotopic Mass:240.208930132
Topological Polar Surface Area:26.3
Heavy Atom Count:17
Complexity:227
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Recommended Suppliers of Citronellyl valerate

Hebei Longbang Technology Co., Ltd Contact Supplier

CN
2 YRS

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7540-53-6 CITRONELLYL VALERATE

CAS No.: 7540-53-6

Grade: Chemical Grade

Content: 99%

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Learn More Other Chemicals

Ethyl valerate

539-82-2
Valerate anion

10023-74-2
Bornyl valerate

7549-41-9
Isoamyl valerate Formula

2050-09-1
Sodium valerate Formula

6106-41-8
Citronellyl nitrile Formula

51566-62-2
Citronellyl anthranilate Structure

68555-57-7
Citronellyl acetate Structure

150-84-5
What is Citronellyl propionate

141-14-0
What is Citronellyl isovalerate

68922-10-1

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Guide of Citronellyl valerate

Description
Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
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Citronellyl valerate

SDS

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