Basic information
- CAS
132316-35-9- Standard SMILES
CCCCC(CC)COC(=O)c1ccc(N(C)C)cc1.COc1ccc(C(=O)CC(=O)c2ccc(C(C)(C)C)cc2)cc1- InChIKey
GDHLLGRPDUYNRS-UHFFFAOYSA-N- Molecular formula
- C37H49NO5
- Average molar mass
- 587.8 g/mol
- Monoisotopic mass
- 587.36107366
Overview
contains 7% padimate O & 3% Parsol 1789; has proven absorption throughout the UVB and UVA spectrum
Names & identifiers
- Preferred name
- Avobenzone, padimate O drug combination
- IUPAC
- 1-(4-tert-butylphenyl)-3-(4-methoxyphenyl)propane-1,3-dione;2-ethylhexyl 4-(dimethylamino)benzoate
- English name
- Photoplex
- Molecular formula
- C37H49NO5
- Molecular weight
- 587.78866
Names & synonyms
132316-35-9Avobenzone, padimate O drug combinationAvonbenzone-padimate ORefChem:115799Avonbenzone - padimate OSCHEMBL26983697DTXSID909276312-Ethylhexyl 4-(dimethylamino)benzoate--1-(4-tert-butylphenyl)-3-(4-methoxyphenyl)propane-1,3-dione (1/1)Benzoic acid, 4-(dimethylamino)-, 2-ethylhexyl ester, mixt. with 1-(4-(1,1-dimethylethyl)phenyl)-3-(4-methoxyphenyl)-1,3-propanedionePhotoplex
Database identifiers
- CAS
132316-35-9- PubChem CID
- 131502
- DTXSID
DTXSID90927631
Properties
Computed structural properties
- Topological polar surface area
- 72.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 15
- Heavy atoms
- 43
- Formal charge
- 0
- Complexity
- 675
Chemistry & industry
Pharmacology
MeSH Pharmacological ClassificationChemical or physical agents that protect the skin from sunburn and erythema by absorbing or blocking ultraviolet radiation.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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