ethyl 2-(2-chloroacetamido)-4,5-dimethylthiophene-3-carboxylate

ethyl 2-(2-chloroacetamido)-4,5-dimethylthiophene-3-carboxylate

CAS: 60442-34-4

Formula: C11H14ClNO3S

SMILES: CCOC(=O)C1=C(NC(=O)CCl)SC(C)=C1C

IUPAC: ethyl 2-(2-chloroacetamido)-4,5-dimethylthiophene-3-carboxylate

InChI: InChI=1S/C11H14ClNO3S/c1-4-16-11(15)9-6(2)7(3)17-10(9)13-8(14)5-12/h4-5H2,1-3H3,(H,13,14)

Composition: C (47.91%), H (5.12%), Cl (12.86%), N (5.08%), O (17.41%), S (11.63%)

Molar Mass: 275.75

Atom Count: 31

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	275.0382922
Formal Charge	0
FSP3	0.45
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	DEYWPOMMNZZPJB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	68.81
Topological Polar Surface Area	55.4
Polarizability	25.63
Ring Count	1
Rotatable Bond Count	5

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