Name: Name:6-Benzothiazolecarboxaldehyde, 2,3-dihydro-3-methyl-2-oxo-
Brand: Angene
SKU: AG00213W
Rating: 90 (10 reviews)

6-Benzothiazolecarboxaldehyde, 2,3-dihydro-3-methyl-2-oxo-

CAS No.:

175693-04-6

Catalog Number:

AG00213W

Molecular Formula:

C9H7NO2S

Molecular Weight:

193.2224

Catalog Number:

AG00213W

Chemical Name:

6-Benzothiazolecarboxaldehyde, 2,3-dihydro-3-methyl-2-oxo-

CAS Number:

175693-04-6

Molecular Formula:

C9H7NO2S

Molecular Weight:

193.2224

MDL Number:

MFCD22061314

IUPAC Name:

3-methyl-2-oxo-1,3-benzothiazole-6-carbaldehyde

InChI:

InChI=1S/C9H7NO2S/c1-10-7-3-2-6(5-11)4-8(7)13-9(10)12/h2-5H,1H3

InChI Key:

LYNTYPVVJROQNF-UHFFFAOYSA-N

SMILES:

O=Cc1ccc2c(c1)sc(=O)n2C

Complexity:

244

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

193.02g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

193.22g/mol

Monoisotopic Mass:

193.02g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

62.7A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.4