Name: Name:ethyl 7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazole-2-carboxylate
Brand: Angene
SKU: AG01BVB7
Rating: 90 (10 reviews)

ethyl 7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazole-2-carboxylate

CAS No.:

154404-91-8

Catalog Number:

AG01BVB7

Molecular Formula:

C10H11NO3S

Molecular Weight:

225.2642

Catalog Number:

AG01BVB7

Chemical Name:

ethyl 7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazole-2-carboxylate

CAS Number:

154404-91-8

Molecular Formula:

C10H11NO3S

Molecular Weight:

225.2642

MDL Number:

MFCD28010841

IUPAC Name:

ethyl 7-oxo-5,6-dihydro-4H-1,3-benzothiazole-2-carboxylate

InChI:

InChI=1S/C10H11NO3S/c1-2-14-10(13)9-11-6-4-3-5-7(12)8(6)15-9/h2-5H2,1H3

InChI Key:

ZZMWDVVCXPSVTQ-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1nc2c(s1)C(=O)CCC2

Complexity:

282

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

225.046g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

225.262g/mol

Monoisotopic Mass:

225.046g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

84.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3: