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1263284-49-6 | Benzenemethanamine, 3-[(4-methoxyphenyl)amino]-
CAS No: 1263284-49-6 Catalog No: AG000SM7 MDL No:
Product Description
Catalog Number:
AG000SM7
Chemical Name:
Benzenemethanamine, 3-[(4-methoxyphenyl)amino]-
CAS Number:
1263284-49-6
Molecular Formula:
C14H16N2O
Molecular Weight:
228.2896
IUPAC Name:
3-(aminomethyl)-N-(4-methoxyphenyl)aniline
InChI:
InChI=1S/C14H16N2O/c1-17-14-7-5-12(6-8-14)16-13-4-2-3-11(9-13)10-15/h2-9,16H,10,15H2,1H3
InChI Key:
RWRQJZPZLQGQAK-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)Nc1cccc(c1)CN
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.126g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
228.295g/mol
Monoisotopic Mass:
228.126g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
47.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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