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[1,1′-Bicyclohexyl]-4-one

[1,1′-Bicyclohexyl]-4-one structure

CAS No:
92-68-2
Formula:
C12H20O
Chemical Name:
[1,1′-Bicyclohexyl]-4-one
Synonyms:
[1,1′-Bicyclohexyl]-4-one;Cyclohexanone,4-cyclohexyl-;C 66;4-Cyclohexylcyclohexanone;NSC 22250;NSC 33962;[1,1′-Bi(cyclohexan)]-4-one

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[1,1′-Bicyclohexyl]-4-one Basic Attributes

Molecular Weight：

180.291

Exact Mass：

180.29

EC Number：

202-178-7

UNII：

6SLH0OPI94

NSC Number：

33962|22250

DSSTox ID：

DTXSID8040721

HScode：

2914299000

Characteristics

PSA：

17.1

XLogP3：

3.32600

Density：

0.984±0.06 g/cm3(Predicted)

Melting Point：

29.2 °C

Boiling Point：

70-72 °C @ Press: 0.1 Torr

Safety Information

Precautionary statement(s)：

P280, P305+P351+P338, P310

Hazard Statements：

H318

GHS Classification：

|Danger|H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]|P280, P305+P351+P338, and P310|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.

[1,1′-Bicyclohexyl]-4-one Use and Manufacturing

Manufacturing Info：

[1,1'-Bicyclohexyl]one: INACTIVE|[1,1'-Bicyclohexyl]-4-one: INACTIVE

Computed Properties

Molecular Weight:180.29
XLogP3:3.4
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:180.151415257
Monoisotopic Mass:180.151415257
Topological Polar Surface Area:17.1
Heavy Atom Count:13
Complexity:170
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of [1,1′-Bicyclohexyl]-4-one

Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties

[1,1′-Bicyclohexyl]-4-one

SDS

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