(2E)-3-(4-hydroxy-3-iodophenyl)-2-[(E)-morpholine-4-carbonyl]prop-2-enenitrile

(2E)-3-(4-hydroxy-3-iodophenyl)-2-[(E)-morpholine-4-carbonyl]prop-2-enenitrile

Formula: C14H13IN2O3

SMILES: OC1=CC=C(C=C(/C#N)C(=O)N2CCOCC2)C=C1I

IUPAC: (2E)-3-(4-hydroxy-3-iodophenyl)-2-[(E)-morpholine-4-carbonyl]prop-2-enenitrile

InChI: InChI=1S/C14H13IN2O3/c15-12-8-10(1-2-13(12)18)7-11(9-16)14(19)17-3-5-20-6-4-17/h1-2,7-8,18H,3-6H2/b11-7+

Composition: C (43.77%), H (3.41%), I (33.03%), N (7.29%), O (12.49%)

Molar Mass: 384.173

Atom Count: 33

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	383.99709
Formal Charge	0
FSP3	0.29
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	GZXMXHTUMIXBSM-YRNVUSSQSA-N
Lipinski's Rule of Five	1
Molar Refractivity	84.15
Topological Polar Surface Area	73.56
Polarizability	31.7
Ring Count	2
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C14H13IN2O3		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00