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Home > Imidazoles > 1020670-55-6
1020670-55-6 | N-(1H-imidazol-2-ylmethyl)-3-methylaniline
CAS No: 1020670-55-6 Catalog No: AG01AZZU MDL No:MFCD14693372
Product Description
Catalog Number:
AG01AZZU
Chemical Name:
N-(1H-imidazol-2-ylmethyl)-3-methylaniline
CAS Number:
1020670-55-6
Molecular Formula:
C11H13N3
Molecular Weight:
187.2410
MDL Number:
MFCD14693372
IUPAC Name:
N-(1H-imidazol-2-ylmethyl)-3-methylaniline
InChI:
InChI=1S/C11H13N3/c1-9-3-2-4-10(7-9)14-8-11-12-5-6-13-11/h2-7,14H,8H2,1H3,(H,12,13)
InChI Key:
FYLDOJVDEWITGG-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1)NCc1ncc[nH]1
Properties
Complexity:
172
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:
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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