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1017470-41-5 | 1H-Benzimidazole-2-methanamine, 1-ethyl-α-phenyl-
CAS No: 1017470-41-5 Catalog No: AG0005DM MDL No:MFCD09902255
Product Description
Catalog Number:
AG0005DM
Chemical Name:
1H-Benzimidazole-2-methanamine, 1-ethyl-α-phenyl-
CAS Number:
1017470-41-5
Molecular Formula:
C16H17N3
Molecular Weight:
251.3263
MDL Number:
MFCD09902255
IUPAC Name:
(1-ethylbenzimidazol-2-yl)-phenylmethanamine
InChI:
InChI=1S/C16H17N3/c1-2-19-14-11-7-6-10-13(14)18-16(19)15(17)12-8-4-3-5-9-12/h3-11,15H,2,17H2,1H3
InChI Key:
QTVJTPHOVNEFGM-UHFFFAOYSA-N
SMILES:
CCn1c(nc2c1cccc2)C(c1ccccc1)N
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.142g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
251.333g/mol
Monoisotopic Mass:
251.142g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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