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14700-66-4 | 1H-Imidazol-2-amine, N-(phenylmethyl)-
CAS No: 14700-66-4 Catalog No: AG001EHQ MDL No:
Product Description
Catalog Number:
AG001EHQ
Chemical Name:
1H-Imidazol-2-amine, N-(phenylmethyl)-
CAS Number:
14700-66-4
Molecular Formula:
C10H11N3
Molecular Weight:
173.2144
IUPAC Name:
N-benzyl-1H-imidazol-2-amine
InChI:
InChI=1S/C10H11N3/c1-2-4-9(5-3-1)8-13-10-11-6-7-12-10/h1-7H,8H2,(H2,11,12,13)
InChI Key:
PTNWKQXEYUQQCU-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)CNc1ncc[nH]1
Properties
Complexity:
143
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.095g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
173.219g/mol
Monoisotopic Mass:
173.095g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
40.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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