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287378-76-1 | Benzothiazole, 2-(2-propenylsulfinyl)- (9CI)
CAS No: 287378-76-1 Catalog No: AG00BLN5 MDL No:
Product Description
Catalog Number:
AG00BLN5
Chemical Name:
Benzothiazole, 2-(2-propenylsulfinyl)- (9CI)
CAS Number:
287378-76-1
IUPAC Name:
2-prop-2-enylsulfinyl-1,3-benzothiazole
InChI:
InChI=1S/C10H9NOS2/c1-2-7-14(12)10-11-8-5-3-4-6-9(8)13-10/h2-6H,1,7H2
InChI Key:
AQLIRLLECJXLJR-UHFFFAOYSA-N
Properties
Complexity:
244
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:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.308g/mol
Monoisotopic Mass:
223.013g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
77.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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