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Methyl 2-bromobenzoate

Methyl 2-bromobenzoate structure

CAS No:
610-94-6
Formula:
C8H7BrO2
Chemical Name:
Methyl 2-bromobenzoate
Synonyms:
Benzoic acid,2-bromo-,methyl ester;Benzoic acid,o-bromo-,methyl ester;Methyl o-bromobenzoate;Methyl 2-bromobenzoate;2-Bromobenzoic acid methyl ester;NSC 7318;4-Bromo-3-benzoic acid methyl ester
Categories:
Chemical Reagents > Organic Reagents

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Description

CLEAR LIGHT YELLOW LIQUID

Methyl 2-bromobenzoate Basic Attributes

Molecular Weight：

215.04

Exact Mass：

215.04

BRN：

1862501

EC Number：

210-241-5

NSC Number：

7318

DSSTox ID：

DTXSID2060593

HScode：

29163990

Characteristics

PSA：

26.3

XLogP3：

2.4

Appearance：

Clear light yellow Liquid

Density：

1.5±0.1 g/cm3

Melting Point：

252°C

Boiling Point：

252 °C

Flash Point：

>230 °F

Refractive Index：

1.550

Water Solubility：

H2O: insoluble

Storage Conditions：

Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

36/37/38

safety instructions：

24/25

Marks：

Stability/Shelf Life：

Stable at room temperature in closed containers under normal storage and handling conditions.

Precautionary statement(s)：

P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, P501

Hazard Statements：

H302

GHS Classification：

|Warning|H302 (33.33%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 3 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Methyl 2-bromobenzoate Use and Manufacturing

Manufacturing Info：

Benzoic acid, 2-bromo-, methyl ester: INACTIVE

Computed Properties

Molecular Weight:215.04
XLogP3:2.4
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:213.96294
Monoisotopic Mass:213.96294
Topological Polar Surface Area:26.3
Heavy Atom Count:11
Complexity:147
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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