N-[(3,5-dichlorophenyl)methyl]-4-propoxyaniline

N-[(3,5-dichlorophenyl)methyl]-4-propoxyaniline

CAS: 1040689-13-1

Formula: C16H17Cl2NO

SMILES: CCCOC1=CC=C(NCC2=CC(Cl)=CC(Cl)=C2)C=C1

IUPAC: N-[(3,5-dichlorophenyl)methyl]-4-propoxyaniline

InChI: InChI=1S/C16H17Cl2NO/c1-2-7-20-16-5-3-15(4-6-16)19-11-12-8-13(17)10-14(18)9-12/h3-6,8-10,19H,2,7,11H2,1H3

Composition: C (61.95%), H (5.52%), Cl (22.85%), N (4.52%), O (5.16%)

Molar Mass: 310.22

Atom Count: 37

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	309.0687196
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	QPPDLBSTRUUXET-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	86.21
Topological Polar Surface Area	21.26
Polarizability	32.83
Ring Count	2
Rotatable Bond Count	6

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