Deshydroxy Bicalutamide
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Deshydroxy Bicalutamide
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CAS No:
906008-94-4
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Formula:
C18H14F4N2O3S
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Chemical Name:
Deshydroxy Bicalutamide
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Synonyms:
Deshydroxy Bicalutamide;N-[4-Cyano-3-(trifluoroMethyl)phenyl]-3-[(4-fluorophenyl)sulfonyl]-2-MethylpropanaMide;BicalutaMide Deshydroxy IMpurity;Bicalutamide EP Impurity C;Bicalutamide impurity D;(RS)-N-[4-Cyano-3-(trifluoromethyl)phenyl]-3-[(4-fluorophenyl) sulfonyl]-2-methyl-propanamide
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CAS No:
Characteristics
95.4
5.49498
1.45g/cm3
154-156 °C(Solv: ethyl acetate (141-78-6); hexane (110-54-3))
612.1ºC at 760 mmHg
324ºC
1.558
Safety Information
P201, P202, P273, P281, P308+P313, P391, P405, P501
H351
|Danger|H351 (100%): Suspected of causing cancer [Warning Carcinogenicity]|P201, P202, P273, P281, P308+P313, P391, P405, and P501|Aggregated GHS information provided by 3 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:414.4
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:414.06612613
Monoisotopic Mass:414.06612613
Topological Polar Surface Area:95.4
Heavy Atom Count:28
Complexity:703
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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