Name: Name:2,3,4,5,6,7-hexahydro-1,3-benzothiazol-2-one
Brand: Angene
SKU: AG01A8RK
Rating: 90 (10 reviews)

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

CAS No.:

57001-13-5

Catalog Number:

AG01A8RK

Molecular Formula:

C7H9NOS

Molecular Weight:

155.2175

Catalog Number:

AG01A8RK

Chemical Name:

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

CAS Number:

57001-13-5

Molecular Formula:

C7H9NOS

Molecular Weight:

155.2175

MDL Number:

MFCD11632173

IUPAC Name:

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

InChI:

InChI=1S/C7H9NOS/c9-7-8-5-3-1-2-4-6(5)10-7/h1-4H2,(H,8,9)

InChI Key:

KCDMCROFMWMVBV-UHFFFAOYSA-N

SMILES:

O=c1sc2c([nH]1)CCCC2

Complexity:

210

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

155.04g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

155.215g/mol

Monoisotopic Mass:

155.04g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

54.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3