N-benzyl-3,4-dichloroaniline

N-benzyl-3,4-dichloroaniline

CAS: 51597-75-2

Formula: C13H11Cl2N

SMILES: ClC1=CC=C(NCC2=CC=CC=C2)C=C1Cl

IUPAC: N-benzyl-3,4-dichloroaniline

InChI: InChI=1S/C13H11Cl2N/c14-12-7-6-11(8-13(12)15)16-9-10-4-2-1-3-5-10/h1-8,16H,9H2

Composition: C (61.93%), H (4.40%), Cl (28.12%), N (5.56%)

Molar Mass: 252.14

Atom Count: 27

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	251.0268548
Formal Charge	0
FSP3	0.08
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	PYRNSWQKFKLMLR-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	70.47
Topological Polar Surface Area	12.03
Polarizability	26.65
Ring Count	2
Rotatable Bond Count	3

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