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Home > Fluorides > 1314987-35-3
1314987-35-3 | 1H-Benzimidazole, 1-(1,1-dimethylethyl)-6,7-difluoro-
CAS No: 1314987-35-3 Catalog No: AG000WBS MDL No:MFCD19684116
Product Description
Catalog Number:
AG000WBS
Chemical Name:
1H-Benzimidazole, 1-(1,1-dimethylethyl)-6,7-difluoro-
CAS Number:
1314987-35-3
Molecular Formula:
C11H12F2N2
Molecular Weight:
210.2232
MDL Number:
MFCD19684116
IUPAC Name:
1-tert-butyl-6,7-difluorobenzimidazole
InChI:
InChI=1S/C11H12F2N2/c1-11(2,3)15-6-14-8-5-4-7(12)9(13)10(8)15/h4-6H,1-3H3
InChI Key:
IIINQDFVLFHIGO-UHFFFAOYSA-N
SMILES:
Fc1ccc2c(c1F)n(cn2)C(C)(C)C
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.097g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.228g/mol
Monoisotopic Mass:
210.097g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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