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88871-84-5 | 5,6-Dihydro-4H-cyclopenta[d][1,3]thiazole-2-thiol
CAS No: 88871-84-5 Catalog No: AG01DP1Y MDL No:MFCD12827908
Product Description
Catalog Number:
AG01DP1Y
Chemical Name:
5,6-Dihydro-4H-cyclopenta[d][1,3]thiazole-2-thiol
CAS Number:
88871-84-5
Molecular Formula:
C6H7NS2
Molecular Weight:
157.2565
MDL Number:
MFCD12827908
IUPAC Name:
3,4,5,6-tetrahydrocyclopenta[d][1,3]thiazole-2-thione
InChI:
InChI=1S/C6H7NS2/c8-6-7-4-2-1-3-5(4)9-6/h1-3H2,(H,7,8)
InChI Key:
PLOKMYNAYRKCND-UHFFFAOYSA-N
SMILES:
Sc1sc2c(n1)CCC2
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.002g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
157.249g/mol
Monoisotopic Mass:
157.002g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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