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87-28-5 | 2-Hydroxyethyl 2-hydroxybenzoate
CAS No: 87-28-5 Catalog No: AG004LSV MDL No:MFCD00002862
Product Description
Catalog Number:
AG004LSV
Chemical Name:
2-Hydroxyethyl 2-hydroxybenzoate
CAS Number:
87-28-5
Molecular Formula:
C9H10O4
Molecular Weight:
182.1733
MDL Number:
MFCD00002862
IUPAC Name:
2-hydroxyethyl 2-hydroxybenzoate
InChI:
InChI=1S/C9H10O4/c10-5-6-13-9(12)7-3-1-2-4-8(7)11/h1-4,10-11H,5-6H2
InChI Key:
LVYLCBNXHHHPSB-UHFFFAOYSA-N
SMILES:
OCCOC(=O)c1ccccc1O
EC Number:
201-737-2
UNII:
3I1VBB7AXH
NSC Number:
72097
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.058g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
182.175g/mol
Monoisotopic Mass:
182.058g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
Literature
| Title | Journal |
|---|---|
| [Skin toxicity related to Percutalgine(®): analysis of the French pharmacovigilance database]. | Annales de dermatologie et de venereologie 20120501 |
| 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 |
| Allergic contact dermatitis from a veterinary antiinflammatory gel containing 2-hydroxyethyl salicylate. | Dermatitis : contact, atopic, occupational, drug 20110501 |
| Arnica/Hydroxyethyl salicylate combination spray for ankle distortion: a four-arm randomised double-blind study. | Pain research and treatment 20110101 |
| Synergetic analgesic effect of the combination of arnica and hydroxyethyl salicylate in ethanolic solution following cutaneous application by transcutaneous electrostimulation. | Arzneimittel-Forschung 20030101 |
| Contact dermatitis from anti-inflammatory gel containing hydroxyethyl salicylate. | Contact dermatitis 20020801 |
| Discovery of HIV-1 integrase inhibitors by pharmacophore searching. | Journal of medicinal chemistry 19970314 |
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