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13604-19-8 | Benzothiazole, 2-(vinylsulfinyl)- (8CI)
CAS No: 13604-19-8 Catalog No: AG00A3PR MDL No:
Product Description
Catalog Number:
AG00A3PR
Chemical Name:
Benzothiazole, 2-(vinylsulfinyl)- (8CI)
CAS Number:
13604-19-8
IUPAC Name:
2-ethenylsulfinyl-1,3-benzothiazole
InChI:
InChI=1S/C9H7NOS2/c1-2-13(11)9-10-7-5-3-4-6-8(7)12-9/h2-6H,1H2
InChI Key:
VPEBNYFNQLYWPR-UHFFFAOYSA-N
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.997g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.281g/mol
Monoisotopic Mass:
208.997g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
77.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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