Home Halogens 1,3,4-Thiadiazol-2-amine, 5-(3-bromophenyl)-

1,3,4-Thiadiazol-2-amine, 5-(3-bromophenyl)-

CAS No.:
108656-65-1
Catalog Number:
AG00HB7Y
Molecular Formula:
C8H6BrN3S
Molecular Weight:
256.1223
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Product Description
Catalog Number:
AG00HB7Y
Chemical Name:
1,3,4-Thiadiazol-2-amine, 5-(3-bromophenyl)-
CAS Number:
108656-65-1
Molecular Formula:
C8H6BrN3S
Molecular Weight:
256.1223
MDL Number:
MFCD01590338
IUPAC Name:
5-(3-bromophenyl)-1,3,4-thiadiazol-2-amine
InChI:
InChI=1S/C8H6BrN3S/c9-6-3-1-2-5(4-6)7-11-12-8(10)13-7/h1-4H,(H2,10,12)
InChI Key:
GQKBSBAYTFZMIR-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)c1nnc(s1)N
Properties
Complexity:
181  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.947g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
256.121g/mol
Monoisotopic Mass:
254.947g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties