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75238-58-3 | 1,2,5-Thiadiazole, 3-ethenyl-
CAS No: 75238-58-3 Catalog No: AG005CNP MDL No:
Product Description
Catalog Number:
AG005CNP
Chemical Name:
1,2,5-Thiadiazole, 3-ethenyl-
CAS Number:
75238-58-3
Molecular Formula:
C4H4N2S
Molecular Weight:
112.1530
IUPAC Name:
3-ethenyl-1,2,5-thiadiazole
InChI:
InChI=1S/C4H4N2S/c1-2-4-3-5-7-6-4/h2-3H,1H2
InChI Key:
PZJNMFYUWBZULM-UHFFFAOYSA-N
SMILES:
C=Cc1cnsn1
Properties
Complexity:
74.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
112.01g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
112.15g/mol
Monoisotopic Mass:
112.01g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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