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Home > Imidazoles > 937660-36-1
937660-36-1 | 4-(4,5-dimethyl-1H-imidazol-2-yl)aniline
CAS No: 937660-36-1 Catalog No: AG01BU98 MDL No:MFCD08457289
Product Description
Catalog Number:
AG01BU98
Chemical Name:
4-(4,5-dimethyl-1H-imidazol-2-yl)aniline
CAS Number:
937660-36-1
Molecular Formula:
C11H13N3
Molecular Weight:
187.2410
MDL Number:
MFCD08457289
IUPAC Name:
4-(4,5-dimethyl-1H-imidazol-2-yl)aniline
InChI:
InChI=1S/C11H13N3/c1-7-8(2)14-11(13-7)9-3-5-10(12)6-4-9/h3-6H,12H2,1-2H3,(H,13,14)
InChI Key:
PYWMECFHNMIGEG-UHFFFAOYSA-N
SMILES:
Nc1ccc(cc1)c1[nH]c(c(n1)C)C
Properties
Complexity:
187
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.111g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
187.246g/mol
Monoisotopic Mass:
187.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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