Home Carboxys 2-Mercapto-1h-imidazole-5-carboxylic acid

2-Mercapto-1h-imidazole-5-carboxylic acid

CAS No.:
25271-85-6
Catalog Number:
AG00BET0
Molecular Formula:
C4H4N2O2S
Molecular Weight:
144.1518
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$289
- +
5g
95%
In Stock USA
United States
$858
- +
Product Description
Catalog Number:
AG00BET0
Chemical Name:
2-Mercapto-1h-imidazole-5-carboxylic acid
CAS Number:
25271-85-6
Molecular Formula:
C4H4N2O2S
Molecular Weight:
144.1518
MDL Number:
MFCD03130326
IUPAC Name:
2-sulfanylidene-1,3-dihydroimidazole-4-carboxylic acid
InChI:
InChI=1S/C4H4N2O2S/c7-3(8)2-1-5-4(9)6-2/h1H,(H,7,8)(H2,5,6,9)
InChI Key:
WXWUKJOVARUSTN-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnc([nH]1)S
Properties
Complexity:
199  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.999g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
144.148g/mol
Monoisotopic Mass:
143.999g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
93.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5  
Properties