Home Carboxys 5-(Propan-2-yl)-1,2,3-thiadiazole-4-carboxylic acid

5-(Propan-2-yl)-1,2,3-thiadiazole-4-carboxylic acid

CAS No.:
1445950-78-6
Catalog Number:
AG00HX3O
Molecular Formula:
C6H8N2O2S
Molecular Weight:
172.2049
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$147
- +
250mg
95%
In Stock USA
United States
$252
- +
1g
95%
In Stock USA
United States
$504
- +
5g
95%
In Stock USA
United States
$1512
- +
Product Description
Catalog Number:
AG00HX3O
Chemical Name:
5-(Propan-2-yl)-1,2,3-thiadiazole-4-carboxylic acid
CAS Number:
1445950-78-6
Molecular Formula:
C6H8N2O2S
Molecular Weight:
172.2049
MDL Number:
MFCD22390323
IUPAC Name:
5-propan-2-ylthiadiazole-4-carboxylic acid
InChI:
InChI=1S/C6H8N2O2S/c1-3(2)5-4(6(9)10)7-8-11-5/h3H,1-2H3,(H,9,10)
InChI Key:
FQXHCVGEIKERNE-UHFFFAOYSA-N
SMILES:
CC(c1snnc1C(=O)O)C
Properties
Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.031g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
172.202g/mol
Monoisotopic Mass:
172.031g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
91.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties