3-ethoxy-4-(2-oxopiperidin-1-yl)benzonitrile

3-ethoxy-4-(2-oxopiperidin-1-yl)benzonitrile

Formula: C14H16N2O2

SMILES: CCOC1=C(C=CC(=C1)C#N)N1CCCCC1=O

IUPAC: 3-ethoxy-4-(2-oxopiperidin-1-yl)benzonitrile

InChI: InChI=1S/C14H16N2O2/c1-2-18-13-9-11(10-15)6-7-12(13)16-8-4-3-5-14(16)17/h6-7,9H,2-5,8H2,1H3

Composition: C (68.83%), H (6.60%), N (11.47%), O (13.10%)

Molar Mass: 244.294

Atom Count: 34

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	244.121177763
Formal Charge	0
FSP3	0.43
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	DAAQTSOHIITPLH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	68.47
Topological Polar Surface Area	53.33
Polarizability	26.19
Ring Count	2
Rotatable Bond Count	3

Suppliers

Struchem co.,ltd

Supplier Profile

Purity	LeadTime	Formula	PacketSize	UnitPrice
95%	<5 Days	C14H16N2O2		$840.00-$2,530.00$840.00$1,540.00$2,530.00