Home Amines 100097-66-3
100097-66-3,MFCD20690872
Catalog No.:AA0000TT
100097-66-3 | 1,2,3-Thiadiazole-4-carbothioamide, 5-amino-
Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95.0%
1 week  
$130.00
- +
250mg
95.0%
1 week  
$173.00
- +
500mg
95.0%
1 week  
$300.00
- +
1g
95.0%
1 week  
$416.00
- +
2.5g
95.0%
1 week  
$786.00
- +
5g
95.0%
1 week  
$1,147.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0000TT
Chemical Name:
1,2,3-Thiadiazole-4-carbothioamide, 5-amino-
CAS Number:
100097-66-3
Molecular Formula:
C3H4N4S2
Molecular Weight:
160.2207
MDL Number:
MFCD20690872
IUPAC Name:
5-aminothiadiazole-4-carbothioamide
InChI:
InChI=1S/C3H4N4S2/c4-2(8)1-3(5)9-7-6-1/h5H2,(H2,4,8)
InChI Key:
XBSUFSWYJXYZSW-UHFFFAOYSA-N
SMILES:
NC(=S)c1nnsc1N
Properties
Computed Properties
 
Complexity:
127  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
159.988g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
160.213g/mol
Monoisotopic Mass:
159.988g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
138A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  

Synonyms
 
5-Amino-1,2,3-thiadiazole-4-carbothioamide 
1,2,3-Thiadiazole-4-carbothioamide, 5-amino- 
CID11084170 
100097-66-3 
ACMC-20m36f 
CTK0E0344 
XBSUFSWYJXYZSW-UHFFFAOYSA- 
DTXSID40454563 
ZINC38220361 
InChI=1/C3H4N4S2/c4-2(8)1-3(5)9-7-6-1/h5H2,(H2,4,8) 
5-aminothiadiazole-4-carbothioamide 
Literature
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