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2-chloro-N-[(3,5-dichlorophenyl)methyl]aniline

2-chloro-N-[(3,5-dichlorophenyl)methyl]aniline

CAS: 1040691-77-7

Formula: C13H10Cl3N

SMILES: ClC1=CC(CNC2=C(Cl)C=CC=C2)=CC(Cl)=C1

IUPAC: 2-chloro-N-[(3,5-dichlorophenyl)methyl]aniline

InChI: InChI=1S/C13H10Cl3N/c14-10-5-9(6-11(15)7-10)8-17-13-4-2-1-3-12(13)16/h1-7,17H,8H2

Composition: C (54.48%), H (3.52%), Cl (37.11%), N (4.89%)

Molar Mass: 286.58

Atom Count: 27

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 284.9878824
Formal Charge 0
FSP3 0.08
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey JGWJGWHQZYMQCN-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 75.28
Topological Polar Surface Area 12.03
Polarizability 28.52
Ring Count 2
Rotatable Bond Count 3

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