(2E)-2-[(E)-benzoyl]-3-[4-(benzyloxy)-3-ethoxyphenyl]prop-2-enenitrile

(2E)-2-[(E)-benzoyl]-3-[4-(benzyloxy)-3-ethoxyphenyl]prop-2-enenitrile

Formula: C25H21NO3

SMILES: CCOC1=CC(C=C(/C#N)C(=O)C2=CC=CC=C2)=CC=C1OCC1=CC=CC=C1

IUPAC: (2E)-2-[(E)-benzoyl]-3-[4-(benzyloxy)-3-ethoxyphenyl]prop-2-enenitrile

InChI: InChI=1S/C25H21NO3/c1-2-28-24-16-20(13-14-23(24)29-18-19-9-5-3-6-10-19)15-22(17-26)25(27)21-11-7-4-8-12-21/h3-16H,2,18H2,1H3/b22-15+

Composition: C (78.31%), H (5.52%), N (3.65%), O (12.52%)

Molar Mass: 383.447

Atom Count: 50

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	383.15214354
Formal Charge	0
FSP3	0.12
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	SVRQUXAYJMMJDY-PXLXIMEGSA-N
Lipinski's Rule of Five
Molar Refractivity	114.22
Topological Polar Surface Area	59.32
Polarizability	43.42
Ring Count	3
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C25H21NO3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00