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4-[(3-aminophenyl)methyl]aniline

4-[(3-aminophenyl)methyl]aniline

CAS: 19430-83-2

Formula: C13H14N2

SMILES: NC1=CC=C(CC2=CC=CC(N)=C2)C=C1

IUPAC: 4-[(3-aminophenyl)methyl]aniline

InChI: InChI=1S/C13H14N2/c14-12-6-4-10(5-7-12)8-11-2-1-3-13(15)9-11/h1-7,9H,8,14-15H2

Composition: C (78.75%), H (7.12%), N (14.13%)

Molar Mass: 198.269

Atom Count: 29

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 198.115698459
Formal Charge 0
FSP3 0.08
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey FGWQCROGAHMWSU-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 65.2
Topological Polar Surface Area 52.04
Polarizability 24.01
Ring Count 2
Rotatable Bond Count 2

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