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27410-48-6 | 2(3H)-Benzothiazolethione,3-propyl-(9CI)
CAS No: 27410-48-6 Catalog No: AG00BSNP MDL No:
Product Description
Catalog Number:
AG00BSNP
Chemical Name:
2(3H)-Benzothiazolethione,3-propyl-(9CI)
CAS Number:
27410-48-6
IUPAC Name:
3-propyl-1,3-benzothiazole-2-thione
InChI:
InChI=1S/C10H11NS2/c1-2-7-11-8-5-3-4-6-9(8)13-10(11)12/h3-6H,2,7H2,1H3
InChI Key:
BHKQRONBQWEYJB-UHFFFAOYSA-N
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.033g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
209.325g/mol
Monoisotopic Mass:
209.033g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
60.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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