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2-Bromo-4-methylanisole

2-Bromo-4-methylanisole structure

CAS No:
22002-45-5
Formula:
C8H9BrO
Chemical Name:
2-Bromo-4-methylanisole
Synonyms:
Benzene,2-bromo-1-methoxy-4-methyl-;Anisole,2-bromo-4-methyl-;2-Bromo-1-methoxy-4-methylbenzene;2-Bromo-4-methylanisole;3-Bromo-4-methoxytoluene;m-Bromo-p-methoxytoluene;1-Bromo-2-methoxy-5-methylbenzene
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Description

Clear colourless to light yellow liquid

2-Bromo-4-methylanisole Basic Attributes

Molecular Weight：

201.06

Exact Mass：

201.06

EC Number：

244-705-3

UNII：

HUX4EC3EUD

DSSTox ID：

DTXSID5066746

HScode：

2909309090

Characteristics

PSA：

9.2

XLogP3：

3.16

Density：

1.4±0.1 g/cm3

Melting Point：

199 °C

Boiling Point：

222 °C @ Press: 760 Torr

Flash Point：

>230 °F

Refractive Index：

1.535

Storage Conditions：

Room temperature.

Safety Information

Hazard category：

IRRITANT

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

26-36

Marks：

Hazard note：

Irritant

Precautionary statement(s)：

P261-P305 + P351 + P338

Hazard Statements：

H315-H319-H335

GHS Classification：

|Warning|H315 (97.56%): 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|Aggregated GHS information provided by 41 companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

2-Bromo-4-methylanisole Use and Manufacturing

Manufacturing Info：

Benzene, 2-bromo-1-methoxy-4-methyl-: INACTIVE

Computed Properties

Molecular Weight:201.06
XLogP3:3.1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:199.98368
Monoisotopic Mass:199.98368
Topological Polar Surface Area:9.2
Heavy Atom Count:10
Complexity:105
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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