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85446-16-8 | 1,3,5-Triazine-2,4(1H,3H)-dithione, 6-(2-propenylamino)-
CAS No: 85446-16-8 Catalog No: AG004JXL MDL No:
Product Description
Catalog Number:
AG004JXL
Chemical Name:
1,3,5-Triazine-2,4(1H,3H)-dithione, 6-(2-propenylamino)-
CAS Number:
85446-16-8
Molecular Formula:
C6H8N4S2
Molecular Weight:
200.2845
IUPAC Name:
6-(prop-2-enylamino)-1H-1,3,5-triazine-2,4-dithione
InChI:
InChI=1S/C6H8N4S2/c1-2-3-7-4-8-5(11)10-6(12)9-4/h2H,1,3H2,(H3,7,8,9,10,11,12)
InChI Key:
SIDSBOJOQUVUGW-UHFFFAOYSA-N
SMILES:
C=CCNc1nc(=S)[nH]c(=S)[nH]1
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.019g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
200.278g/mol
Monoisotopic Mass:
200.019g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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