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Home > Fluorides > 1314987-78-4
1314987-78-4 | 1H-Benzimidazole, 1-ethyl-6,7-difluoro-
CAS No: 1314987-78-4 Catalog No: AG000WCS MDL No:MFCD19684115
Product Description
Catalog Number:
AG000WCS
Chemical Name:
1H-Benzimidazole, 1-ethyl-6,7-difluoro-
CAS Number:
1314987-78-4
Molecular Formula:
C9H8F2N2
Molecular Weight:
182.1700
MDL Number:
MFCD19684115
IUPAC Name:
1-ethyl-6,7-difluorobenzimidazole
InChI:
InChI=1S/C9H8F2N2/c1-2-13-5-12-7-4-3-6(10)8(11)9(7)13/h3-5H,2H2,1H3
InChI Key:
XAZWKKRGQRHLPL-UHFFFAOYSA-N
SMILES:
CCn1cnc2c1c(F)c(cc2)F
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.066g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.174g/mol
Monoisotopic Mass:
182.066g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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