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Home Aminos Benzoic acid, 2-(acetyloxy)-, 4-(acetylamino)phenyl ester

Benzoic acid, 2-(acetyloxy)-, 4-(acetylamino)phenyl ester

CAS No.:
5003-48-5
Catalog Number:
AG00I8XC
Molecular Formula:
C17H15NO5
Molecular Weight:
313.3047
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%(HPLC)
In Stock USA
United States
$53
- +
5g
98%(HPLC)
In Stock USA
United States
$107
- +
25g
98%(HPLC)
In Stock USA
United States
$322
- +
Product Description
Catalog Number:
AG00I8XC
Chemical Name:
Benzoic acid, 2-(acetyloxy)-, 4-(acetylamino)phenyl ester
CAS Number:
5003-48-5
Molecular Formula:
C17H15NO5
Molecular Weight:
313.3047
MDL Number:
MFCD00864257
IUPAC Name:
(4-acetamidophenyl) 2-acetyloxybenzoate
InChI:
InChI=1S/C17H15NO5/c1-11(19)18-13-7-9-14(10-8-13)23-17(21)15-5-3-4-6-16(15)22-12(2)20/h3-10H,1-2H3,(H,18,19)
InChI Key:
FEJKLNWAOXSSNR-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccc(cc1)OC(=O)c1ccccc1OC(=O)C
EC Number:
225-674-5
UNII:
W1QX9DV96G
Properties
Complexity:
442  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.095g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
313.309g/mol
Monoisotopic Mass:
313.095g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
81.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Literature
Title Journal
A rapid and sensitive LC-MS/MS assay for the quantitation of deacetyl mycoepoxydiene in rat plasma with application to preclinical pharmacokinetics studies. Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20120101
Dielectric study of equimolar acetaminophen-aspirin, acetaminophen-quinidine, and benzoic acid-progesterone molecular alloys in the glass and ultraviscous states and their relevance to solubility and stability. Journal of pharmaceutical sciences 20100301
Insights in to the pathogenesis of axial spondyloarthropathy based on gene expression profiles. Arthritis research & therapy 20090101
Calorimetric relaxation in pharmaceutical molecular glasses and its utility in understanding their stability against crystallization. The journal of physical chemistry. B 20080904
Overuse of non-prescription analgesics by dental clinic patients. BMC oral health 20080101
Effect of pressure on molecular and ionic motions in ultraviscous acetaminophen-aspirin mixture. Journal of pharmaceutical sciences 20061101
Determination of benorilate in pharmaceutical formulations and its metabolite in urine at carbon paste electrode modified by silver nanoparticles. Talanta 20050915
Comparison of aspirin and benorylate in the treatment of rheumatoid arthritis. British medical journal 19720527
Properties