Name: Name:8-thiatricyclo[7.4.0.0,2,7]trideca-1(13),2(7),9,11-tetraen-6-one
Brand: Angene
SKU: AG019YH4
Rating: 90 (10 reviews)

8-thiatricyclo[7.4.0.0,2,7]trideca-1(13),2(7),9,11-tetraen-6-one

CAS No.:

24444-98-2

Catalog Number:

AG019YH4

Molecular Formula:

C12H10OS

Molecular Weight:

202.2722

Catalog Number:

AG019YH4

Chemical Name:

8-thiatricyclo[7.4.0.0,2,7]trideca-1(13),2(7),9,11-tetraen-6-one

CAS Number:

24444-98-2

Molecular Formula:

C12H10OS

Molecular Weight:

202.2722

MDL Number:

MFCD23143985

IUPAC Name:

2,3-dihydro-1H-dibenzothiophen-4-one

InChI:

InChI=1S/C12H10OS/c13-10-6-3-5-9-8-4-1-2-7-11(8)14-12(9)10/h1-2,4,7H,3,5-6H2

InChI Key:

DMESSBVCMGBSRF-UHFFFAOYSA-N

SMILES:

O=C1CCCc2c1sc1c2cccc1

Complexity:

251

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

202.045g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

202.271g/mol

Monoisotopic Mass:

202.045g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

45.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.4