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3,4-Dimethylbenzyl alcohol

3,4-Dimethylbenzyl alcohol structure

CAS No:
6966-10-5
Formula:
C9H12O
Chemical Name:
3,4-Dimethylbenzyl alcohol
Synonyms:
Benzenemethanol,3,4-dimethyl-;Benzyl alcohol,3,4-dimethyl-;3,4-Dimethylbenzenemethanol;3,4-Dimethylbenzyl alcohol;3,4-Dimethylphenylmethanol;NSC 18728
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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3,4-Dimethylbenzyl alcohol Basic Attributes

Molecular Weight：

136.19100

Exact Mass：

136.19

EC Number：

230-175-0

NSC Number：

18728

DSSTox ID：

DTXSID60219954

HScode：

2906299090

Characteristics

PSA：

20.23000

XLogP3：

1.79570

Appearance：

white to light yellow crystal powder

Density：

1.002g/cm3

Melting Point：

61-62 °C

Boiling Point：

218-221ºC

Flash Point：

218-221ºC

Refractive Index：

1.536

Safety Information

wgk germany：

hazard class code：

R22; R36/37/38

safety instructions：

S22-S26-S36/37/39

Marks：

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Computed Properties

Molecular Weight:136.19
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:136.088815002
Monoisotopic Mass:136.088815002
Topological Polar Surface Area:20.2
Heavy Atom Count:10
Complexity:101
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3,4-Dimethylbenzyl alcohol

Basic Attributes
Characteristics
Safety Information
Computed Properties
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