Name: Name:2,2-dimethyl-3,4-dihydro-2H-1lambda4-benzothiopyran-1,4-dione
Brand: Angene
SKU: AG01BTGG
Rating: 90 (10 reviews)

2,2-dimethyl-3,4-dihydro-2H-1lambda4-benzothiopyran-1,4-dione

CAS No.:

13189-17-8

Catalog Number:

AG01BTGG

Molecular Formula:

C11H12O2S

Molecular Weight:

208.2768

Catalog Number:

AG01BTGG

Chemical Name:

2,2-dimethyl-3,4-dihydro-2H-1lambda4-benzothiopyran-1,4-dione

CAS Number:

13189-17-8

Molecular Formula:

C11H12O2S

Molecular Weight:

208.2768

MDL Number:

MFCD03236766

IUPAC Name:

2,2-dimethyl-1-oxo-3H-thiochromen-4-one

InChI:

InChI=1S/C11H12O2S/c1-11(2)7-9(12)8-5-3-4-6-10(8)14(11)13/h3-6H,7H2,1-2H3

InChI Key:

WOOJHNTVFKIULA-UHFFFAOYSA-N

SMILES:

O=S1c2ccccc2C(=O)CC1(C)C

Complexity:

283

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

208.056g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

208.275g/mol

Monoisotopic Mass:

208.056g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

53.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.1