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75815-15-5 | Benzenamine, 4-(5-methyl-1H-imidazol-4-yl)-
CAS No: 75815-15-5 Catalog No: AG005ICF MDL No:
Product Description
Catalog Number:
AG005ICF
Chemical Name:
Benzenamine, 4-(5-methyl-1H-imidazol-4-yl)-
CAS Number:
75815-15-5
Molecular Formula:
C10H11N3
Molecular Weight:
173.2144
IUPAC Name:
4-(5-methyl-1H-imidazol-4-yl)aniline
InChI:
InChI=1S/C10H11N3/c1-7-10(13-6-12-7)8-2-4-9(11)5-3-8/h2-6H,11H2,1H3,(H,12,13)
InChI Key:
ZHOYVFPSBCXAGM-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)c1nc[nH]c1C
Properties
Complexity:
164
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:
1
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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