3-BROMOMANDELIC ACID
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3-BROMOMANDELIC ACID
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CAS No:
49839-81-8
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Formula:
C8H7BrO3
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Chemical Name:
3-BROMOMANDELIC ACID
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Synonyms:
3-Bromomandelic acid;2-(3-bromophenyl)-2-hydroxyacetic acid;(3-bromophenyl)(hydroxy)acetic acid;m-Bromomandelic acid;SCHEMBL742998;CTK8F0599;(3-bromophenyl)hydroxyacetic acid;DTXSID80373704;3-Bromo-a-hydroxy-benzeneacetic acid;4295AE
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CAS No:
Safety Information
IRRITANT
Xi
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, P501
H302
|Warning|H302 (50%): 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|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:231.04
XLogP3:1.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:229.95786
Monoisotopic Mass:229.95786
Topological Polar Surface Area:57.5
Heavy Atom Count:12
Complexity:172
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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