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Home > Bromides > 1314988-10-7
1314988-10-7 | 1H-Benzimidazole, 5-bromo-6-fluoro-1-(phenylmethyl)-
CAS No: 1314988-10-7 Catalog No: AG000WCO MDL No:MFCD19684120
Product Description
Catalog Number:
AG000WCO
Chemical Name:
1H-Benzimidazole, 5-bromo-6-fluoro-1-(phenylmethyl)-
CAS Number:
1314988-10-7
Molecular Formula:
C14H10BrFN2
Molecular Weight:
305.1450
MDL Number:
MFCD19684120
IUPAC Name:
1-benzyl-5-bromo-6-fluorobenzimidazole
InChI:
InChI=1S/C14H10BrFN2/c15-11-6-13-14(7-12(11)16)18(9-17-13)8-10-4-2-1-3-5-10/h1-7,9H,8H2
InChI Key:
WZHHXIVITKECOT-UHFFFAOYSA-N
SMILES:
Brc1cc2ncn(c2cc1F)Cc1ccccc1
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.001g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
305.15g/mol
Monoisotopic Mass:
304.001g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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