3-Bromobutanoic acid
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3-Bromobutanoic acid
structure -
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CAS No:
2623-86-1
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Formula:
C4H7BrO2
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Chemical Name:
3-Bromobutanoic acid
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Synonyms:
Butanoic acid,3-bromo-;Butyric acid,3-bromo-;3-Bromobutanoic acid;3-Bromobutyric acid;β-Bromobutyric acid;(±)-3-Bromobutyric acid;77732-34-4
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CAS No:
Safety Information
III
UN 3265 8/PG 3
3
R34
S26-S45-S36-S37-S39
C
P280-P305 + P351 + P338-P310
H314
|Danger|H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]|P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501|Aggregated GHS information provided by 43 companies from 3 notifications to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:167.00
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:165.96294
Monoisotopic Mass:165.96294
Topological Polar Surface Area:37.3
Heavy Atom Count:7
Complexity:72.1
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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