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41286-42-4 | N1-Methyl-N-4-phenylbenzene-1,4-diamine
CAS No: 41286-42-4 Catalog No: AG01FCGV MDL No:
Product Description
Catalog Number:
AG01FCGV
Chemical Name:
N1-Methyl-N-4-phenylbenzene-1,4-diamine
CAS Number:
41286-42-4
Molecular Formula:
C13H14N2
Molecular Weight:
198.2637
IUPAC Name:
1-N-methyl-4-N-phenylbenzene-1,4-diamine
InChI:
InChI=1S/C13H14N2/c1-14-11-7-9-13(10-8-11)15-12-5-3-2-4-6-12/h2-10,14-15H,1H3
InChI Key:
GYXXGCCWYRAYGT-UHFFFAOYSA-N
SMILES:
CNc1ccc(cc1)Nc1ccccc1
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.116g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
198.269g/mol
Monoisotopic Mass:
198.116g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
24.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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