ethyl 2-cyano-3-(3-fluorophenyl)prop-2-enoate

ethyl 2-cyano-3-(3-fluorophenyl)prop-2-enoate

Formula: C12H10FNO2

SMILES: CCOC(=O)C(=CC1=CC(F)=CC=C1)C#N

IUPAC: ethyl 2-cyano-3-(3-fluorophenyl)prop-2-enoate

InChI: InChI=1S/C12H10FNO2/c1-2-16-12(15)10(8-14)6-9-4-3-5-11(13)7-9/h3-7H,2H2,1H3

Composition: C (65.75%), H (4.60%), F (8.67%), N (6.39%), O (14.60%)

Molar Mass: 219.215

Atom Count: 26

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	219.069556729
Formal Charge	0
FSP3	0.17
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	KRAONHPSLKXRMO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.85
Topological Polar Surface Area	50.09
Polarizability	21.43
Ring Count	1
Rotatable Bond Count	4

Suppliers

Kinentia Biosciences LLC

Supplier Profile

Purity	LeadTime	Formula	PacketSize	UnitPrice
97%	<14 Days	C12H10FNO2		$187.11-$280.67$187.11$280.67