200,000+ products from a single source!
sales@angenechem.com
89155-07-7 | 2(3H)-Benzothiazolone, 3-(thiiranylmethyl)-
CAS No: 89155-07-7 Catalog No: AG003X9X MDL No:
Product Description
Catalog Number:
AG003X9X
Chemical Name:
2(3H)-Benzothiazolone, 3-(thiiranylmethyl)-
CAS Number:
89155-07-7
Molecular Formula:
C10H9NOS2
Molecular Weight:
223.3146
IUPAC Name:
3-(thiiran-2-ylmethyl)-1,3-benzothiazol-2-one
InChI:
InChI=1S/C10H9NOS2/c12-10-11(5-7-6-13-7)8-3-1-2-4-9(8)14-10/h1-4,7H,5-6H2
InChI Key:
DICUZNMOOWBTLR-UHFFFAOYSA-N
SMILES:
O=c1sc2c(n1CC1CS1)cccc2
NSC Number:
653502
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.013g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.308g/mol
Monoisotopic Mass:
223.013g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
70.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.