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Home > Bromides > 1231930-33-8
1231930-33-8 | 1H-Benzimidazole, 6-bromo-4-fluoro-2-methyl-1-(1-methylethyl)-
CAS No: 1231930-33-8 Catalog No: AG000K57 MDL No:MFCD16660227
Product Description
Catalog Number:
AG000K57
Chemical Name:
1H-Benzimidazole, 6-bromo-4-fluoro-2-methyl-1-(1-methylethyl)-
CAS Number:
1231930-33-8
Molecular Formula:
C11H12BrFN2
Molecular Weight:
271.1288
MDL Number:
MFCD16660227
IUPAC Name:
6-bromo-4-fluoro-2-methyl-1-propan-2-ylbenzimidazole
InChI:
InChI=1S/C11H12BrFN2/c1-6(2)15-7(3)14-11-9(13)4-8(12)5-10(11)15/h4-6H,1-3H3
InChI Key:
SJQZRZLUEGCXFN-UHFFFAOYSA-N
SMILES:
Brc1cc(F)c2c(c1)n(C(C)C)c(n2)C
EC Number:
807-019-0
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.017g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.133g/mol
Monoisotopic Mass:
270.017g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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