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Basic information
- CAS
6500-50-1- Standard SMILES
CCCCCCCCOC(=O)c1ccc([N+](=O)[O-])cc1- InChIKey
WHZYPQVZYYTVFW-UHFFFAOYSA-N- Molecular formula
- C15H21NO4
- Average molar mass
- 279.336 g/mol
- Monoisotopic mass
- 279.14705815
Names & identifiers
- Preferred name
- Benzoic acid, 4-nitro-, octyl ester
- IUPAC
- Octyl 4-nitrobenzoate
- English name
- octyl p-nitrobenzoate
- Molecular formula
- C15H21NO4
- Molecular weight
- 279.33
Names & synonyms
Einecs 229-382-9octyl p-nitrobenzoate2-ethylhexyl 4-nitrobenzoate2-ETHYLHEXYL P-NITROBENZOATE4-Nitrobenzoic acid octyl esterBenzoic acid, 4-nitro-, octyl ester
Database identifiers
- CAS
6500-50-1- PubChem CID
- 80997
- DTXSID
DTXSID9064392- EC Number
- 229-382-9
- Nikkaji
- J225.156F
Properties
Physicochemical properties
- storage temp.
- Refrigerator
- solubility
- DMSO (Sparingly), Methanol (Slightly)
- form
- Oil
- color
- Light Yellow
- EPA Substance Registry System
- 4 · Benzoic acid, 4-nitro-, octyl ester (6500-50-1)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Applications
Uses2-Ethylhexyl 4-Nitrobenzoate is an intermediate in the synthesis of 2-Ethylhexyl-4-aminobenzoate (E918745) which is an impurity in the synthesis of Ethylhexyl Triazone (E918810), used in sunscreen formulations as a UV filter to block out harmful ultraviolet light.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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