2-(3-ethyl-4-oxo-1,3-thiazolidin-2-ylidene)propanedinitrile

2-(3-ethyl-4-oxo-1,3-thiazolidin-2-ylidene)propanedinitrile

CAS: 623558-68-9

Formula: C8H7N3OS

SMILES: CCN1C(=O)CSC1=C(C#N)C#N

IUPAC: 2-(3-ethyl-4-oxo-1,3-thiazolidin-2-ylidene)propanedinitrile

InChI: InChI=1S/C8H7N3OS/c1-2-11-7(12)5-13-8(11)6(3-9)4-10/h2,5H2,1H3

Composition: C (49.73%), H (3.65%), N (21.75%), O (8.28%), S (16.59%)

Molar Mass: 193.22

Atom Count: 20

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	193.030983031
Formal Charge	0
FSP3	0.37
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	UVOQLYXMOFOJJE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	59.69
Topological Polar Surface Area	67.89
Polarizability	18.53
Ring Count	1
Rotatable Bond Count	1

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<5 Days	623558-68-9		$16.39-$75.66$16.39$29.00$75.66