N-[2-(2,4-dichlorophenoxy)ethyl]-4-(oxolan-2-ylmethoxy)aniline

N-[2-(2,4-dichlorophenoxy)ethyl]-4-(oxolan-2-ylmethoxy)aniline

CAS: 1040690-23-0

Formula: C19H21Cl2NO3

SMILES: ClC1=CC(Cl)=C(OCCNC2=CC=C(OCC3CCCO3)C=C2)C=C1

IUPAC: N-[2-(2,4-dichlorophenoxy)ethyl]-4-[(oxolan-2-yl)methoxy]aniline

InChI: InChI=1/C19H21Cl2NO3/c20-14-3-8-19(18(21)12-14)24-11-9-22-15-4-6-16(7-5-15)25-13-17-2-1-10-23-17/h3-8,12,17,22H,1-2,9-11,13H2

Composition: C (59.70%), H (5.54%), Cl (18.55%), N (3.66%), O (12.56%)

Molar Mass: 382.28

Atom Count: 46

Heavy Atom Count: 25

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	1
Exact Mass	381.0898489
Formal Charge	0
FSP3	0.37
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	SGHUUTBCESHPMD-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	101.13
Topological Polar Surface Area	39.72
Polarizability	39.04
Ring Count	3
Rotatable Bond Count	8

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