4-(2-Chlorophenyl)-1,2,3-thiadiazol-5-amine - CAS 1538121-87-7
Catalog: |
BB070272 |
Product Name: |
4-(2-Chlorophenyl)-1,2,3-thiadiazol-5-amine |
CAS: |
1538121-87-7 |
Synonyms: |
4-(2-CHLOROPHENYL)-1,2,3-THIADIAZOL-5-AMINE; 4-(2-chlorophenyl)thiadiazol-5-amine |
IUPAC Name: | 4-(2-chlorophenyl)thiadiazol-5-amine |
Description: | 4-(2-Chlorophenyl)-1,2,3-thiadiazol-5-amine |
Molecular Weight: | 211.67 |
Molecular Formula: | C8H6ClN3S |
Canonical SMILES: | C1=CC=C(C(=C1)C2=C(SN=N2)N)Cl |
InChI: | InChI=1S/C8H6ClN3S/c9-6-4-2-1-3-5(6)7-8(10)13-12-11-7/h1-4H,10H2 |
InChI Key: | HHANUWMJQBWODS-UHFFFAOYSA-N |
Complexity: | 181 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 210.9970961 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 210.9970961 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 80Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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