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3-Cyclohexene-1,1-dimethanol

3-Cyclohexene-1,1-dimethanol structure

CAS No:
2160-94-3
Formula:
C8H14O2
Chemical Name:
3-Cyclohexene-1,1-dimethanol
Synonyms:
3-Cyclohexene-1,1-dimethanol;1,1-Bis(hydroxymethyl)-3-cyclohexene;4,4-Bis(hydroxymethyl)-1-cyclohexene;4,4-Bis(hydroxymethyl)cyclohexene;1-Cyclohexene-4,4-dimethanol;NSC 112688;[1-(Hydroxymethyl)cyclohex-3-en-1-yl]methanol
Categories:
Chemical Reagents > Organic Reagents

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Description

BEIGE FINE CRYSTALLINE POWDER

3-Cyclohexene-1,1-dimethanol Basic Attributes

Molecular Weight：

142.2

Exact Mass：

142.20

EC Number：

218-481-2

NSC Number：

112688

DSSTox ID：

DTXSID40175968

HScode：

2906199090

Characteristics

PSA：

40.5

XLogP3：

0.69750

Density：

1.05g/cm3

Melting Point：

92 °C

Boiling Point：

128 °C @ Press: 3 Torr

Flash Point：

105ºC

Refractive Index：

1.497

Safety Information

wgk germany：

hazard class code：

22-36/37/38

safety instructions：

RTECS Number：

GW6050000

Marks：

Precautionary statement(s)：

P264, P270, P301+P312, P330, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P264, P270, P301+P312, P330, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:142.20
XLogP3:0.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:142.099379685
Monoisotopic Mass:142.099379685
Topological Polar Surface Area:40.5
Heavy Atom Count:10
Complexity:125
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-Cyclohexene-1,1-dimethanol

Description
Basic Attributes
Characteristics
Safety Information
Computed Properties
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3-Cyclohexene-1,1-dimethanol

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