2,5-dichloro-N-[(3-methylphenyl)methyl]aniline

2,5-dichloro-N-[(3-methylphenyl)methyl]aniline

CAS: 1040084-20-5

Formula: C14H13Cl2N

SMILES: CC1=CC=CC(CNC2=C(Cl)C=CC(Cl)=C2)=C1

IUPAC: 2,5-dichloro-N-[(3-methylphenyl)methyl]aniline

InChI: InChI=1S/C14H13Cl2N/c1-10-3-2-4-11(7-10)9-17-14-8-12(15)5-6-13(14)16/h2-8,17H,9H2,1H3

Composition: C (63.18%), H (4.92%), Cl (26.64%), N (5.26%)

Molar Mass: 266.17

Atom Count: 30

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	265.0425048
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	JVUINUTYFFBAFG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	75.52
Topological Polar Surface Area	12.03
Polarizability	28.39
Ring Count	2
Rotatable Bond Count	3

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