Name: Name:6-methyl-2,3,4,5,6,7-hexahydro-1,3-benzothiazol-2-one
Brand: Angene
SKU: AG01A8RR
Rating: 90 (10 reviews)

6-methyl-2,3,4,5,6,7-hexahydro-1,3-benzothiazol-2-one

CAS No.:

101870-28-4

Catalog Number:

AG01A8RR

Molecular Formula:

C8H11NOS

Molecular Weight:

169.2440

Catalog Number:

AG01A8RR

Chemical Name:

6-methyl-2,3,4,5,6,7-hexahydro-1,3-benzothiazol-2-one

CAS Number:

101870-28-4

Molecular Formula:

C8H11NOS

Molecular Weight:

169.2440

MDL Number:

MFCD11632139

IUPAC Name:

6-methyl-4,5,6,7-tetrahydro-3H-1,3-benzothiazol-2-one

InChI:

InChI=1S/C8H11NOS/c1-5-2-3-6-7(4-5)11-8(10)9-6/h5H,2-4H2,1H3,(H,9,10)

InChI Key:

VPMKHVJBRIMNFB-UHFFFAOYSA-N

SMILES:

CC1CCc2c(C1)sc(=O)[nH]2

Complexity:

234

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

169.056g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

169.242g/mol

Monoisotopic Mass:

169.056g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

54.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7