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178367-92-5 | 1,2,5-Thiadiazole, 3-chloro-4-(propylthio)-
CAS No: 178367-92-5 Catalog No: AG0025YV MDL No:
Product Description
Catalog Number:
AG0025YV
Chemical Name:
1,2,5-Thiadiazole, 3-chloro-4-(propylthio)-
CAS Number:
178367-92-5
Molecular Formula:
C5H7ClN2S2
Molecular Weight:
194.7055
IUPAC Name:
3-chloro-4-propylsulfanyl-1,2,5-thiadiazole
InChI:
InChI=1S/C5H7ClN2S2/c1-2-3-9-5-4(6)7-10-8-5/h2-3H2,1H3
InChI Key:
XLIKGSZQTIINTG-UHFFFAOYSA-N
SMILES:
CCCSc1nsnc1Cl
Properties
Complexity:
104
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.974g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.695g/mol
Monoisotopic Mass:
193.974g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
79.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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