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Cyclohexanol, 2-(1,1-dimethylpropyl)-, 1-acetate

Cyclohexanol, 2-(1,1-dimethylpropyl)-, 1-acetate structure

CAS No:
67874-72-0
Formula:
C13H24O2
Chemical Name:
Cyclohexanol, 2-(1,1-dimethylpropyl)-, 1-acetate
Synonyms:
Cyclohexanol,2-(1,1-dimethylpropyl)-,1-acetate;Cyclohexanol,2-(1,1-dimethylpropyl)-,acetate;Cyclohexanol,2-tert-pentyl-,acetate;Coniferan;NSC 21163;2-tert-Amylcyclohexyl acetate;2-tert-Pentylcyclohexyl acetate
Categories:
Cosmetic Ingredient > Perfuming

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Description

Coniferan is a carboxylic ester.

Cyclohexanol, 2-(1,1-dimethylpropyl)-, 1-acetate Basic Attributes

Molecular Weight：

212.32800

Exact Mass：

212.33

EC Number：

267-500-0

UNII：

4SMO7U026F

NSC Number：

21163

DSSTox ID：

DTXSID0044573

Characteristics

PSA：

26.30000

XLogP3：

3.54450

Appearance：

colorless liquid

Density：

0.92g/cm3

Boiling Point：

239.6ºC at 760mmHg

Refractive Index：

1.452

Water Solubility：

2.404 mg/L @ 25 °C (est)

Safety Information

GHS Classification：

|H411 (100%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]|P273, P391, and P501|Aggregated GHS information provided by 1651 companies from 6 notifications to the ECHA C&L Inventory.

Drug Information

MeSH Entry Terms：

amylcyclohexyl acetate

Cyclohexanol, 2-(1,1-dimethylpropyl)-, 1-acetate Use and Manufacturing

Uses

Air care products

Production

< 25,000 lb

Manufacturing Info：

Cyclohexanol, 2-(1,1-dimethylpropyl)-, 1-acetate: ACTIVE

Computed Properties

Molecular Weight:212.33
XLogP3:4.1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:212.177630004
Monoisotopic Mass:212.177630004
Topological Polar Surface Area:26.3
Heavy Atom Count:15
Complexity:221
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Cyclohexanol, 2-(1,1-dimethylpropyl)-, 1-acetate

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

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