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Home Other Building Blocks 2-Amino-5-trifluoromethyl-1,3,4-thiadiazole

2-Amino-5-trifluoromethyl-1,3,4-thiadiazole

CAS No.:
10444-89-0
Catalog Number:
AG003GHS
Molecular Formula:
C3H2F3N3S
Molecular Weight:
169.1283
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$17
- +
5g
97%
In Stock USA
United States
$44
- +
25g
97%
In Stock USA
United States
$163
- +
100g
97%
In Stock USA
United States
$625
- +
Product Description
Catalog Number:
AG003GHS
Chemical Name:
2-Amino-5-trifluoromethyl-1,3,4-thiadiazole
CAS Number:
10444-89-0
Molecular Formula:
C3H2F3N3S
Molecular Weight:
169.1283
MDL Number:
MFCD00003109
IUPAC Name:
5-(trifluoromethyl)-1,3,4-thiadiazol-2-amine
InChI:
InChI=1S/C3H2F3N3S/c4-3(5,6)1-8-9-2(7)10-1/h(H2,7,9)
InChI Key:
LTEUXHSAYOSFGQ-UHFFFAOYSA-N
SMILES:
FC(c1nnc(s1)N)(F)F
EC Number:
233-930-2
NSC Number:
231655
Properties
Complexity:
127  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.992g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
169.125g/mol
Monoisotopic Mass:
168.992g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
2-Amino-5-trifluoromethyl-1,3,4-thiadiazole and a redetermination of 2-amino-1,3,4-thiadiazole, both at 120 K: chains of edge-fused R(2)(2)(8) and R(4)(4)(10) rings, and sheets of R(2)(2)(8) and R(6)(6)(20) rings. Acta crystallographica. Section C, Crystal structure communications 20060101
Properties