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141211-27-0 | 1H-Benzimidazol-2-amine, 1-butyl-5,6-dimethyl-
CAS No: 141211-27-0 Catalog No: AG001G1S MDL No:
Product Description
Catalog Number:
AG001G1S
Chemical Name:
1H-Benzimidazol-2-amine, 1-butyl-5,6-dimethyl-
CAS Number:
141211-27-0
Molecular Formula:
C13H19N3
Molecular Weight:
217.3101
IUPAC Name:
1-butyl-5,6-dimethylbenzimidazol-2-amine
InChI:
InChI=1S/C13H19N3/c1-4-5-6-16-12-8-10(3)9(2)7-11(12)15-13(16)14/h7-8H,4-6H2,1-3H3,(H2,14,15)
InChI Key:
OKUJNTOCGNYHCJ-UHFFFAOYSA-N
SMILES:
CCCCn1c(N)nc2c1cc(C)c(c2)C
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.158g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
217.316g/mol
Monoisotopic Mass:
217.158g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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