Compound: 2-ETHYLHEXYL SALICYLATE
SMILES: O=C(OCC(CCCC)CC)c1c(O)cccc1
InChIKey: FMRHJJZUHUTGKE-UHFFFAOYSA-N
Synonyms: 2-ETHYLHEXYL SALICYLATE, Octisalate, 118-60-5, 2-Ethylhexyl 2-hydroxybenzoate, Benzoic acid, 2-hydroxy-, 2-ethylhexyl ester, Escalol, Salicylic Acid 2-Ethylhexyl Ester, Octisalato, NSC-46151, DTXSID7040734, 4X49Y0596W, DTXCID5020734, OCTYLSALICYLATE, octisalatum, Tanning Oil, RefChem:856053, Arizona Sun Tanning Oil SPF 3, 204-263-4, Ethylhexyl salicylate, Sunarome WMO, Ethyl hexyl salicylate, Sunarome O, Uvinul, USAF DO-11, Neo Heliopan, Salicylic acid, 2-ethylhexyl ester, MFCD00053300, NSC 46151, WMO, NCGC00159324-02, Octyl salicylate;2-Ethylhexyl salicylate, Octisalate [USAN], CAS-118-60-5, EINECS 204-263-4, BRN 2730664, Octisalate [USAN:USP:INN], Dermoblock OS, UNII-4X49Y0596W, Neo Heliopan OS, Uvinul (TN), Escalol 587, Salicylic acid-2-ethyl-1-hexyl ester, Uvinul O-18, Octisalate (Standard), 2-Hydroxybenzoic acid 2-ethylhexyl ester, OCTISALATE [II], Octisalate (USP/INN), Ethylhexyl salicylic acid, OCTISALATE [INN], OCTISALATE [VANDF], Salicylic Acid Octyl Ester, EC 204-263-4, OCTISALATE [MART.], OCTISALATE [USP-RS], OCTISALATE [WHO-DD], SCHEMBL39594, 2-Ethylhexyl2-hydroxybenzoate, 2-Ethylhexyl salicylate, 99%, orb1311008, orb3139957, CHEMBL1329203, SCHEMBL29362543, CHEBI:88639, HY-B0929R, MSK3405, WLN: QR BVO1Y4 & 2, 2-Ethylhexyl salicylate, >=99%, HMS5085I18, OCTISALATE [USP MONOGRAPH], HY-B0929, NSC46151, Tox21_111573, EBC-26321, ETHYLHEXYL SALICYLATE [VANDF], MSK3405-100A, s6405, SBB008473, STL570066, AKOS015890505, MSK3405-1000A, Tox21_111573_1, CS-4398, DB11062, NCGC00159324-03, NCGC00159324-04, AC-12458, LS-14437, SY052290, 2-hydroxy benzoic acid 2-ethylhexyl ester, DB-041415, 2-Ethylhexyl salicylate, analytical standard, NS00011474, S0387, ST50319550, D05226, F85195, Octisalate Solution in Acetonitrile, 100ug/mL, EN300-7381990, Octisalate Solution in Acetonitrile, 1000ug/mL, F241184, Q27160526, Octisalate, United States Pharmacopeia (USP) Reference Standard, Octisalate, Pharmaceutical Secondary Standard; Certified Reference Material
Theoretical properties:
molecular_formula: C15H22O3
molecular_weight: 250.33 g/mol
exact_mass: 250.15689456 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 1
hydrogen_bond_acceptor_count: 3
rotatable_bond_count: 8
heavy_atom_count: 18
topological_polar_surface_area: 46.5 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
Descriptions:
pubchem: Ethylhexyl salicylate is a member of phenols and a benzoate ester. It is functionally related to a salicylic acid.
chembl: OCTISALATE is a small molecule listed in the ChEMBL database and has reached clinical trial phase 2.0.
wikipedia: 2-Ethylhexyl salicylate, also known as ethylhexyl salicylate (INCI name), octisalate, or octyl salicylate, is an organic compound used as an ingredient in sunscreens and cosmetics to absorb UVB (ultraviolet) rays from the sun. It is an ester formed by the condensation of salicylic acid with 2-ethylhexanol.  It is a colorless oily liquid with a slight floral odor.
The salicylate portion of the molecule absorbs ultraviolet light, protecting skin from the harmful effects of exposure to sunlight.  The ethylhexanol portion is a fatty alcohol, adding emollient and oil-like (water resistant) properties.