Home Other Building Blocks Ethyl salicylate

Ethyl salicylate

CAS No.:
118-61-6
Catalog Number:
AG0033CP
Molecular Formula:
C9H10O3
Molecular Weight:
166.1739
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
95%
In Stock USA
United States
$13
- +
25g
95%
In Stock USA
United States
$25
- +
100g
95%
In Stock USA
United States
$63
- +
Product Description
Catalog Number:
AG0033CP
Chemical Name:
Ethyl salicylate
CAS Number:
118-61-6
Molecular Formula:
C9H10O3
Molecular Weight:
166.1739
MDL Number:
MFCD00002215
IUPAC Name:
ethyl 2-hydroxybenzoate
InChI:
InChI=1S/C9H10O3/c1-2-12-9(11)7-5-3-4-6-8(7)10/h3-6,10H,2H2,1H3
InChI Key:
GYCKQBWUSACYIF-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccccc1O
EC Number:
204-265-5
UNII:
555U6TZ2MV
NSC Number:
8209
FEMA Number:
2458
Properties
Complexity:
156  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.063g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
166.176g/mol
Monoisotopic Mass:
166.063g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Literature
Title Journal
Inverse antagonist activities of parabens on human oestrogen-related receptor γ (ERRγ): in vitro and in silico studies. Toxicology and applied pharmacology 20130701
The estrogenic potential of salicylate esters and their possible risks in foods and cosmetics. Toxicology letters 20120307
Optimization and validation of liquid chromatography and headspace-gas chromatography based methods for the quantitative determination of capsaicinoids, salicylic acid, glycol monosalicylate, methyl salicylate, ethyl salicylate, camphor and l-menthol in a topical formulation. Journal of pharmaceutical and biomedical analysis 20120223
On-line reaction monitoring by extractive electrospray ionisation. Rapid communications in mass spectrometry : RCM 20110530
Natural variation in herbivore-induced volatiles in Arabidopsis thaliana. Journal of experimental botany 20100601
The herbivore-induced plant volatile methyl salicylate negatively affects attraction of the parasitoid Diadegma semiclausum. Journal of chemical ecology 20100501
Structure-toxicity relationship of phenolic analogs as anti-melanoma agents: an enzyme directed prodrug approach. Chemico-biological interactions 20100212
Levels of mint and wintergreen flavorants: smokeless tobacco products vs. confectionery products. Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association 20100201
Anti-aphrodisiac compounds of male butterflies increase the risk of egg parasitoid attack by inducing plant synomone production. Journal of chemical ecology 20091101
Synthesis, characterization and texture observations of calamitic liquid crystalline compounds. International journal of molecular sciences 20091101
Flavour compounds in tomato fruits: identification of loci and potential pathways affecting volatile composition. Journal of experimental botany 20090101
Physicochemical interactions between drugs and superdisintegrants. The Journal of pharmacy and pharmacology 20081201
Encapsulation of methyl and ethyl salicylates by beta-cyclodextrin HPLC, UV-vis and molecular modeling studies. Journal of pharmaceutical and biomedical analysis 20081104
Orosensory-directed identification of astringent mouthfeel and bitter-tasting compounds in red wine. Journal of agricultural and food chemistry 20080227
DFT and ab initio study of structure of dyes derived from 2-hydroxy and 2,4-dihydroxy benzoic acids. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20080201
N'-Ferrocenyl-2-hydroxy-benzohydrazide. Acta crystallographica. Section E, Structure reports online 20080101
4-pyridyl carbonyl and related compounds as thrips lures: effectiveness for onion thrips and new zealand flower thrips in field experiments. Journal of agricultural and food chemistry 20070725
Fragrance material review on ethyl salicylate. Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association 20070101
A rapid HPLC/ESI-MS method for the quantitative determination of oridonin in rat plasma. Die Pharmazie 20060901
[Study on the phosphorylaions reaction between ethyl salicylate and DEPH]. Guang pu xue yu guang pu fen xi = Guang pu 20040301
Percutaneous penetration and skin metabolism of ethylsalicylate-containing agent, TU-2100: in-vitro and in-vivo evaluation in guinea pigs. Journal of controlled release : official journal of the Controlled Release Society 20020219
Properties