Octanoic acid, 2-bromo-, methyl ester
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Octanoic acid, 2-bromo-, methyl ester
structure -
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CAS No:
5445-22-7
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Formula:
C9H17BrO2
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Chemical Name:
Octanoic acid, 2-bromo-, methyl ester
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Synonyms:
Octanoic acid,2-bromo-,methyl ester;Methyl 2-bromooctanoate;NSC 21981;135339-61-6
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CAS No:
Safety Information
R36/38
S26-S36
P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, P362
H315
|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.
Octanoic acid, 2-bromo-, methyl ester Use and Manufacturing
Octanoic acid, 2-bromo-, methyl ester: INACTIVE
Computed Properties
Molecular Weight:237.13
XLogP3:3.8
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:7
Exact Mass:236.04119
Monoisotopic Mass:236.04119
Topological Polar Surface Area:26.3
Heavy Atom Count:12
Complexity:126
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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Octanoic acid, 2-bromo-, methyl ester
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