(R,S)-4-Bromohomoibotenic acid
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(R,S)-4-Bromohomoibotenic acid
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CAS No:
77006-30-5
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Formula:
C6H7BrN2O4
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Chemical Name:
(R,S)-4-Bromohomoibotenic acid
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Synonyms:
5-Isoxazolepropanoic acid,α-amino-4-bromo-2,3-dihydro-3-oxo-;α-Amino-4-bromo-2,3-dihydro-3-oxo-5-isoxazolepropanoic acid;(R,S)-4-Bromohomoibotenic acid;2-Amino-3-(4-bromo-3-hydroxy-1,2-oxazol-5-yl)propanoic acid;2-Amino-3-(4-bromo-3-hydroxyisoxazol-5-yl)propanoic acid;2-Amino-3-(4-bromo-3-oxo-2,3-dihydro-1,2-oxazol-5-yl)propanoic acid;71366-32-0;78729-81-4
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CAS No:
Safety Information
P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P311, P312, P321, P322, P330, P361, P363, P403+P233, P405, P501
H301
|Danger|H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P311, P312, P321, P322, P330, P361, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:251.03
XLogP3:-2.7
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:249.95892
Monoisotopic Mass:249.95892
Topological Polar Surface Area:102
Heavy Atom Count:13
Complexity:288
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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