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122199-83-1 | 1H-Benzimidazole, 2,3-dihydro-1,2,2,3-tetramethyl-5-nitro-
CAS No: 122199-83-1 Catalog No: AG0016X7 MDL No:
Product Description
Catalog Number:
AG0016X7
Chemical Name:
1H-Benzimidazole, 2,3-dihydro-1,2,2,3-tetramethyl-5-nitro-
CAS Number:
122199-83-1
Molecular Formula:
C11H15N3O2
Molecular Weight:
221.2557
IUPAC Name:
1,2,2,3-tetramethyl-5-nitrobenzimidazole
InChI:
InChI=1S/C11H15N3O2/c1-11(2)12(3)9-6-5-8(14(15)16)7-10(9)13(11)4/h5-7H,1-4H3
InChI Key:
DXIFARLRKYLKPI-UHFFFAOYSA-N
SMILES:
CN1c2cc(ccc2N(C1(C)C)C)[N+](=O)[O-]
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.116g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.26g/mol
Monoisotopic Mass:
221.116g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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