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180634-96-2 | 3H-Imidazo[1,5-a]benzimidazole-1-methanamine
CAS No: 180634-96-2 Catalog No: AG002267 MDL No:
Product Description
Catalog Number:
AG002267
Chemical Name:
3H-Imidazo[1,5-a]benzimidazole-1-methanamine
CAS Number:
180634-96-2
Molecular Formula:
C10H10N4
Molecular Weight:
186.2132
IUPAC Name:
3H-imidazo[1,5-a]benzimidazol-1-ylmethanamine
InChI:
InChI=1S/C10H10N4/c11-5-9-12-6-10-13-7-3-1-2-4-8(7)14(9)10/h1-4H,5-6,11H2
InChI Key:
CMXVIYWZLDYKTP-UHFFFAOYSA-N
SMILES:
NCC1=NCc2n1c1ccccc1n2
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.091g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
186.218g/mol
Monoisotopic Mass:
186.091g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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