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Linalyl benzoate

Linalyl benzoate structure

CAS No:
126-64-7
Formula:
C17H22O2
Chemical Name:
Linalyl benzoate
Synonyms:
1,6-Octadien-3-ol,3,7-dimethyl-,3-benzoate;1,6-Octadien-3-ol,3,7-dimethyl-,benzoate;Linalool,benzoate;3,7-Dimethyl-1,6-octadien-3-ol benzoate;3,7-Dimethyl-1,6-octadien-3-yl benzoate;Linalyl benzoate;NSC 71926
Categories:
Cosmetic Ingredient > Perfuming

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Description

Liquid

Liquid|yellowish to amber liquid with a heavy, floral, balsamic, fruity odour

Linalyl benzoate is a monoterpenoid.

Linalyl benzoate Basic Attributes

Molecular Weight：

258.36

Exact Mass：

258.36

EC Number：

204-796-2

NSC Number：

71926

DSSTox ID：

DTXSID2047191

HScode：

2916310090

Characteristics

PSA：

26.3

XLogP3：

6.14

Appearance：

Liquid

Density：

1.0±0.1 g/cm3

Boiling Point：

263 °C

Flash Point：

>230 °F

Refractive Index：

1.512

Water Solubility：

insoluble in water; soluble in organic solvents, oils

Vapor Pressure：

4.79E-05mmHg at 25°C

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

RTECS Number：

DH3300000

Precautionary statement(s)：

P264, P280, P305+P351+P338, P33, P313

Hazard Statements：

H319

GHS Classification：

|Warning|H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]|P264, P280, P305+P351+P338, and P337+P313|Aggregated GHS information provided by 1658 companies from 2 notifications to the ECHA C&L Inventory.

Drug Information

MeSH Entry Terms：

3,7-dimethyl-1,6-octadien-3-yl benzoate

Linalyl benzoate Use and Manufacturing

Methods of Manufacturing

Derived from the reaction of linalool and benzoyl chloride in the presence of pyridine.

Uses

spices. Mainly used in various floral flavors and citrus, mixed fruit, berry flavors.

Manufacturing Info：

1,6-Octadien-3-ol, 3,7-dimethyl-, 3-benzoate: ACTIVE

Use Classification：

Food additives -> Flavoring Agents|Flavoring Agents -> JECFA Flavorings Index

Food Additive Classes：

Flavoring Agents

Computed Properties

Molecular Weight:258.35
XLogP3:5
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:7
Exact Mass:258.161979940
Monoisotopic Mass:258.161979940
Topological Polar Surface Area:26.3
Heavy Atom Count:19
Complexity:333
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Recommended Suppliers of Linalyl benzoate

Tianjin Jinshu Technology Co., Ltd. Contact Supplier

CN
2 YRS

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Trader Supplier of peptone

China Most Professional Factory Supply High Qulity LINALYL BENZOATE

CAS No.: 126-64-7

Grade: Pharmaceutical Grade

Content: 99%

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Guide of Linalyl benzoate

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
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Linalyl benzoate

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