ethyl 2-[(methoxycarbonyl)amino]-4H,5H,6H-cyclopenta[b]thiophene-3-carboxylate

ethyl 2-[(methoxycarbonyl)amino]-4H,5H,6H-cyclopenta[b]thiophene-3-carboxylate

Formula: C12H15NO4S

SMILES: CCOC(=O)C1=C(NC(=O)OC)SC2=C1CCC2

IUPAC: ethyl 2-[(methoxycarbonyl)amino]-4H,5H,6H-cyclopenta[b]thiophene-3-carboxylate

InChI: InChI=1S/C12H15NO4S/c1-3-17-11(14)9-7-5-4-6-8(7)18-10(9)13-12(15)16-2/h3-6H2,1-2H3,(H,13,15)

Composition: C (53.52%), H (5.61%), N (5.20%), O (23.76%), S (11.90%)

Molar Mass: 269.32

Atom Count: 33

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	269.072179141
Formal Charge	0
FSP3	0.5
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	QSNOFQKVGKRDJK-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	68.4
Topological Polar Surface Area	64.63
Polarizability	25.6
Ring Count	2
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C12H15NO4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00