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Home Carboxys 5-(Benzyloxy)-4-oxo-4h-pyran-2-carboxylic acid

5-(Benzyloxy)-4-oxo-4h-pyran-2-carboxylic acid

CAS No.:
1219-33-6
Catalog Number:
AG0016DA
Molecular Formula:
C13H10O5
Molecular Weight:
246.2155
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$55
- +
250mg
95%
In Stock USA
United States
$101
- +
1g
95%
In Stock USA
United States
$220
- +
5g
95%
In Stock USA
United States
$659
- +
Product Description
Catalog Number:
AG0016DA
Chemical Name:
5-(Benzyloxy)-4-oxo-4h-pyran-2-carboxylic acid
CAS Number:
1219-33-6
Molecular Formula:
C13H10O5
Molecular Weight:
246.2155
MDL Number:
MFCD15143595
IUPAC Name:
4-oxo-5-phenylmethoxypyran-2-carboxylic acid
InChI:
InChI=1S/C13H10O5/c14-10-6-11(13(15)16)18-8-12(10)17-7-9-4-2-1-3-5-9/h1-6,8H,7H2,(H,15,16)
InChI Key:
RGZZNPNSZZJJSH-UHFFFAOYSA-N
SMILES:
OC(=O)c1occ(c(=O)c1)OCc1ccccc1
Properties
Complexity:
402  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.053g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
246.218g/mol
Monoisotopic Mass:
246.053g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
72.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Literature
Title Journal
Synthesis, antimicrobial evaluation and QSAR study of some 3-hydroxypyridine-4-one and 3-hydroxypyran-4-one derivatives. European journal of medicinal chemistry 20090501
Properties