ethyl 2-acetamido-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

ethyl 2-acetamido-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Formula: C14H19NO3S

SMILES: CCOC(=O)C1=C(NC(C)=O)SC2=C1CCC(C)C2

IUPAC: ethyl 2-acetamido-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

InChI: InChI=1/C14H19NO3S/c1-4-18-14(17)12-10-6-5-8(2)7-11(10)19-13(12)15-9(3)16/h8H,4-7H2,1-3H3,(H,15,16)

Composition: C (59.76%), H (6.81%), N (4.98%), O (17.06%), S (11.39%)

Molar Mass: 281.37

Atom Count: 38

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	281.10856465
Formal Charge	0
FSP3	0.57
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	MMOGJFVKKPVAKG-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	75.93
Topological Polar Surface Area	55.4
Polarizability	28.51
Ring Count	2
Rotatable Bond Count	4

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C14H19NO3S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00