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933697-35-9 | 1H-BENZO[D]IMIDAZOLE-7-ETHANAMINE
CAS No: 933697-35-9 Catalog No: AG006G7U MDL No:
Product Description
Catalog Number:
AG006G7U
Chemical Name:
1H-BENZO[D]IMIDAZOLE-7-ETHANAMINE
CAS Number:
933697-35-9
Molecular Formula:
C9H11N3
Molecular Weight:
161.2037
IUPAC Name:
2-(1H-benzimidazol-4-yl)ethanamine
InChI:
InChI=1S/C9H11N3/c10-5-4-7-2-1-3-8-9(7)12-6-11-8/h1-3,6H,4-5,10H2,(H,11,12)
InChI Key:
PEDJZXHXBFJWRK-UHFFFAOYSA-N
SMILES:
NCCc1cccc2c1[nH]cn2
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
161.095g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
161.208g/mol
Monoisotopic Mass:
161.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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