2-[4-(3-fluoropropoxy)phenyl]-3-[(4-phenoxyphenyl)amino]prop-2-enenitrile

2-[4-(3-fluoropropoxy)phenyl]-3-[(4-phenoxyphenyl)amino]prop-2-enenitrile

CAS: 478039-52-0

Formula: C24H21FN2O2

SMILES: FCCCOC1=CC=C(C=C1)C(=CNC1=CC=C(OC2=CC=CC=C2)C=C1)C#N

IUPAC: 2-[4-(3-fluoropropoxy)phenyl]-3-[(4-phenoxyphenyl)amino]prop-2-enenitrile

InChI: InChI=1S/C24H21FN2O2/c25-15-4-16-28-22-11-7-19(8-12-22)20(17-26)18-27-21-9-13-24(14-10-21)29-23-5-2-1-3-6-23/h1-3,5-14,18,27H,4,15-16H2

Composition: C (74.21%), H (5.45%), F (4.89%), N (7.21%), O (8.24%)

Molar Mass: 388.442

Atom Count: 50

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	388.158706087
Formal Charge	0
FSP3	0.12
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	IJVDTAQAZQUQFU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	112.86
Topological Polar Surface Area	54.28
Polarizability	42.38
Ring Count	3
Rotatable Bond Count	9

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Purity	LeadTime	CAS	PacketSize	UnitPrice
90%	<2 Days	478039-52-0		$51.35-$524.40$51.35$63.37$86.31$524.40