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5-BroMo-2-Methoxy-4-Methyl-benzoicacid

5-BroMo-2-Methoxy-4-Methyl-benzoicacid structure

CAS No:
90326-61-7
Formula:
C9H9BrO3
Chemical Name:
5-BroMo-2-Methoxy-4-Methyl-benzoicacid
Synonyms:
5-BroMo-2-Methoxy-4-Methyl-benzoic acid;Benzoic acid, 5-bromo-2-methoxy-4-methyl-

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5-BroMo-2-Methoxy-4-Methyl-benzoicacid Basic Attributes

Molecular Weight：

245.07

Exact Mass：

243.97351

DSSTox ID：

DTXSID20595589

HScode：

2918990090

Characteristics

PSA：

46.53000

XLogP3：

2.46430

Density：

1.546±0.06 g/cm3

Melting Point：

130-133 °C

Boiling Point：

360.2±42.0 °C(Predicted)

PKA：

3.87±0.10

Safety Information

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, 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:245.07
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:243.97351
Monoisotopic Mass:243.97351
Topological Polar Surface Area:46.5
Heavy Atom Count:13
Complexity:195
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: ammonium sulfate formula; benzylamine; polyacrylic acid; propylene carbonate; l-methionine; formula for cupric oxide

Guide of 5-BroMo-2-Methoxy-4-Methyl-benzoicacid

Basic Attributes
Characteristics
Safety Information
Computed Properties

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