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Home Carboxys Ethyl 5,7-dihydroxyisothiazolo[4,3-d]pyrimidine-3-carboxylate

Ethyl 5,7-dihydroxyisothiazolo[4,3-d]pyrimidine-3-carboxylate

CAS No.:
160600-22-6
Catalog Number:
AG00HYLR
Molecular Formula:
C8H7N3O4S
Molecular Weight:
241.2239
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$315
- +
250mg
95%
In Stock USA
United States
$588
- +
1g
95%
In Stock USA
United States
$1176
- +
5g
95%
In Stock USA
United States
$3528
- +
Product Description
Catalog Number:
AG00HYLR
Chemical Name:
Ethyl 5,7-dihydroxyisothiazolo[4,3-d]pyrimidine-3-carboxylate
CAS Number:
160600-22-6
Molecular Formula:
C8H7N3O4S
Molecular Weight:
241.2239
MDL Number:
MFCD22209674
IUPAC Name:
ethyl 5,7-dioxo-4H-[1,2]thiazolo[4,3-d]pyrimidine-3-carboxylate
InChI:
InChI=1S/C8H7N3O4S/c1-2-15-7(13)5-3-4(11-16-5)6(12)10-8(14)9-3/h2H2,1H3,(H2,9,10,12,14)
InChI Key:
ZGYBOXFRGNDLST-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1snc2c1nc(O)nc2O
Properties
Complexity:
348  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.016g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
241.221g/mol
Monoisotopic Mass:
241.016g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
126A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties