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Home > Nitro Compounds > 1606-77-5
1606-77-5 | 1,3,4-Thiadiazole, 2-nitro-
CAS No: 1606-77-5 Catalog No: AG001S29 MDL No:
Product Description
Catalog Number:
AG001S29
Chemical Name:
1,3,4-Thiadiazole, 2-nitro-
CAS Number:
1606-77-5
Molecular Formula:
C2HN3O2S
Molecular Weight:
131.1132
IUPAC Name:
2-nitro-1,3,4-thiadiazole
InChI:
InChI=1S/C2HN3O2S/c6-5(7)2-4-3-1-8-2/h1H
InChI Key:
JQMZIFITLRHNAM-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1nncs1
NSC Number:
150850
Properties
Complexity:
102
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.979g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
131.109g/mol
Monoisotopic Mass:
130.979g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
99.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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