3-CYANO-4-FLUOROBENZYLBROMIDE
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3-CYANO-4-FLUOROBENZYLBROMIDE
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CAS No:
180302-35-6
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Formula:
C8H5BrFN
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Chemical Name:
3-CYANO-4-FLUOROBENZYLBROMIDE
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Synonyms:
3-CYANO-4-FLUOROBENZYL BROMIDE;5-(BroMoMethyl)-2-fluorobenzonitrile;3-Cyano-4-fluorobenzyl bromide, alpha-Bromo-6-fluoro-m-tolunitrile;Benzonitrile, 5-(bromomethyl)-2-fluoro-
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CAS No:
Safety Information
22
C,Xn
|Danger|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
3-CYANO-4-FLUOROBENZYLBROMIDE Use and Manufacturing
3-CYANO-4-FLUOROBENZYL BROMIDE is used in the synthetic preparations of thrombin inhibitors.
Computed Properties
Molecular Weight:214.03
XLogP3:2.3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:212.95894
Monoisotopic Mass:212.95894
Topological Polar Surface Area:23.8
Heavy Atom Count:11
Complexity:174
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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