200,000+ products from a single source!
sales@angenechem.com
Home > Fluorides > 129199-87-7
129199-87-7 | 1H-Benzimidazole, 2,3-dihydro-2,2-dimethyl-4-nitro-6-(trifluoromethyl)-
CAS No: 129199-87-7 Catalog No: AG000YYA MDL No:
Product Description
Catalog Number:
AG000YYA
Chemical Name:
1H-Benzimidazole, 2,3-dihydro-2,2-dimethyl-4-nitro-6-(trifluoromethyl)-
CAS Number:
129199-87-7
Molecular Formula:
C10H10F3N3O2
Molecular Weight:
261.2005
IUPAC Name:
2,2-dimethyl-4-nitro-6-(trifluoromethyl)-1,3-dihydrobenzimidazole
InChI:
InChI=1S/C10H10F3N3O2/c1-9(2)14-6-3-5(10(11,12)13)4-7(16(17)18)8(6)15-9/h3-4,14-15H,1-2H3
InChI Key:
OLLCGAYBKMPGQQ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(cc2c1NC(N2)(C)C)C(F)(F)F
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.073g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
261.204g/mol
Monoisotopic Mass:
261.073g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.