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100925-29-9 | Benzenamine, 4-methoxy-2-methyl-N-(2-methylphenyl)-
CAS No: 100925-29-9 Catalog No: AG00037B MDL No:
Product Description
Catalog Number:
AG00037B
Chemical Name:
Benzenamine, 4-methoxy-2-methyl-N-(2-methylphenyl)-
CAS Number:
100925-29-9
Molecular Formula:
C15H17NO
Molecular Weight:
227.3016
IUPAC Name:
4-methoxy-2-methyl-N-(2-methylphenyl)aniline
InChI:
InChI=1S/C15H17NO/c1-11-6-4-5-7-14(11)16-15-9-8-13(17-3)10-12(15)2/h4-10,16H,1-3H3
InChI Key:
TWTVEAVLDYMIHG-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1)C)Nc1ccccc1C
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.131g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
227.307g/mol
Monoisotopic Mass:
227.131g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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