3-BROMO-4,5-DIMETHOXYBENZOIC ACID
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3-BROMO-4,5-DIMETHOXYBENZOIC ACID
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CAS No:
20731-48-0
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Formula:
C9H9BrO4
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Chemical Name:
3-BROMO-4,5-DIMETHOXYBENZOIC ACID
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Synonyms:
3-bromo-4,5-dimethoxybenzoic acid;Benzoic acid,3-bromo-4,5-dimethoxy-;SCHEMBL1204414;CTK4E4961;DTXSID90384740;HMS1664D22;ZINC163325;5-bromo-3,4-dimethoxybenzoic acid;ALBB-009078;7055AD
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CAS No:
Characteristics
55.8
2.16450
1.571g/cm3
193.0 to 197.0 °C
340.5ºC at 760 mmHg
159.7ºC
1.566
3.32E-05mmHg at 25°C
Safety Information
IRRITANT
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:261.07
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:259.96842
Monoisotopic Mass:259.96842
Topological Polar Surface Area:55.8
Heavy Atom Count:14
Complexity:209
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3-BROMO-4,5-DIMETHOXYBENZOIC ACID
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