Home Other Building Blocks 5-[3-(trifluoromethoxy)phenyl]-1,3,4-thiadiazol-2-amine hydrochloride

5-[3-(trifluoromethoxy)phenyl]-1,3,4-thiadiazol-2-amine hydrochloride

CAS No.:
1803611-19-9
Catalog Number:
AG01B95D
Molecular Formula:
C9H7ClF3N3OS
Molecular Weight:
297.6846
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Product Description
Catalog Number:
AG01B95D
Chemical Name:
5-[3-(trifluoromethoxy)phenyl]-1,3,4-thiadiazol-2-amine hydrochloride
CAS Number:
1803611-19-9
Molecular Formula:
C9H7ClF3N3OS
Molecular Weight:
297.6846
MDL Number:
MFCD28397393
IUPAC Name:
5-[3-(trifluoromethoxy)phenyl]-1,3,4-thiadiazol-2-amine;hydrochloride
InChI:
InChI=1S/C9H6F3N3OS.ClH/c10-9(11,12)16-6-3-1-2-5(4-6)7-14-15-8(13)17-7;/h1-4H,(H2,13,15);1H
InChI Key:
HTLYDHLCMCWEGN-UHFFFAOYSA-N
SMILES:
Nc1nnc(s1)c1cccc(c1)OC(F)(F)F.Cl
Properties
Complexity:
266  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.995g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
297.68g/mol
Monoisotopic Mass:
296.995g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
89.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties