2-bromo-4-cyanobenzoic acid
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2-bromo-4-cyanobenzoic acid
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CAS No:
956218-04-5
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Formula:
C8H4BrNO2
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Chemical Name:
2-bromo-4-cyanobenzoic acid
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Synonyms:
2-BROMO-4-CYANOBENZOIC ACID;KS-00000SC0;ZINC98180480;AKOS024225070;DS-7333;AK152705;SC-31434;CS-0040133
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CAS No:
Safety Information
|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:226.03
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:224.94254
Monoisotopic Mass:224.94254
Topological Polar Surface Area:61.1
Heavy Atom Count:12
Complexity:233
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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