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4-tert-Amylcyclohexanone

4-tert-Amylcyclohexanone structure

CAS No:
16587-71-6
Formula:
C11H20O
Chemical Name:
4-tert-Amylcyclohexanone
Synonyms:
Cyclohexanone,4-(1,1-dimethylpropyl)-;Cyclohexanone,4-tert-pentyl-;4-(1,1-Dimethylpropyl)cyclohexanone;4-tert-Amylcyclohexanone;4-tert-Pentylcyclohexanone;Orivone;NSC 21167;4-(tert-Pentyl)cyclohexan-1-one
Categories:
Cosmetic Ingredient > Perfuming

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4-tert-Amylcyclohexanone Basic Attributes

Molecular Weight：

168.27600

Exact Mass：

168.28

EC Number：

240-642-0

UNII：

5380BWU79X

NSC Number：

21167

DSSTox ID：

DTXSID4047127

HScode：

2914299000

Characteristics

PSA：

17.07000

XLogP3：

3.18190

Density：

0.9245 g/cm³ @ Temp: 20 °C

Melting Point：

96 °C

Boiling Point：

110-113 °C @ Press: 12 Torr

Flash Point：

86.1ºC

Refractive Index：

1.469

Vapor Pressure：

0.0649mmHg at 25°C

Safety Information

hazard class code：

R36/38

safety instructions：

S26-S36

RTECS Number：

GW1960000

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P321, P332+P313, and P362|Aggregated GHS information provided by 1642 companies from 7 notifications to the ECHA C&L Inventory.

4-tert-Amylcyclohexanone Use and Manufacturing

Manufacturing Info：

Cyclohexanone, 4-(1,1-dimethylpropyl)-: ACTIVE

Computed Properties

Molecular Weight:168.28
XLogP3:2.9
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:168.151415257
Monoisotopic Mass:168.151415257
Topological Polar Surface Area:17.1
Heavy Atom Count:12
Complexity:160
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Hot Searches: cadaverine; keratomalacia; chromate charge; sodium propionate; chlorphenamine maleate; sodium diacetate

Guide of 4-tert-Amylcyclohexanone

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

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