1,3,4-Thiadiazol-2-amine, 5-[(4-fluorophenyl)methyl]-


Chemical Name: 1,3,4-Thiadiazol-2-amine, 5-[(4-fluorophenyl)methyl]-
CAS Number: 39181-55-0
Product Number: AG00CHCA(AGN-PC-0JVQST)
Synonyms:
MDL No:
Molecular Formula: C9H8FN3S
Molecular Weight: 209.2433

Identification/Properties


Computed Properties
Molecular Weight:
209.242g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
209.042g/mol
Monoisotopic Mass:
209.042g/mol
Topological Polar Surface Area:
80A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
185
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P332+P313-P337+P313-P362-P403+P233-P405-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



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