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3,4-Dimethylanisole

3,4-Dimethylanisole structure

CAS No:
4685-47-6
Formula:
C9H12O
Chemical Name:
3,4-Dimethylanisole
Synonyms:
Benzene,4-methoxy-1,2-dimethyl-;Anisole,3,4-dimethyl-;4-Methoxy-1,2-dimethylbenzene;3,4-Dimethylanisole;4-Methoxy-o-xylene;1-Methoxy-3,4-dimethylbenzene;3,4-Dimethylphenol methyl ether;1,2-Dimethyl-4-methoxybenzene;2-Methyl-4-methoxytoluene
Categories:
Inorganic Chemistry > Industrial Gases

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Description

CLEAR COLOURLESS LIQUID

3,4-Dimethylanisole Basic Attributes

Molecular Weight：

136.194

Exact Mass：

136.19

EC Number：

225-142-2

DSSTox ID：

DTXSID70196964

HScode：

2909309090

Characteristics

PSA：

9.2

XLogP3：

3.05

Density：

0.9±0.1 g/cm3

Boiling Point：

202 °C

Flash Point：

75.6±0.0 °C

Refractive Index：

1.495

Safety Information

Transport codes：

1993

wgk germany：

hazard class code：

R36/37/38

safety instructions：

S24/25

Marks：

Xi: Irritant;

Precautionary statement(s)：

P261-P280-P305 + P351 + P338

Hazard Statements：

H302-H315-H318-H335

GHS Classification：

|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:136.19
XLogP3:3.2
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:136.088815002
Monoisotopic Mass:136.088815002
Topological Polar Surface Area:9.2
Heavy Atom Count:10
Complexity:101
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes