Basic information
- CAS
78480-23-6- Standard SMILES
CCCCC(CC)COC(=O)c1ccc(N=CNc2ccc(C(=O)OCC(CC)CCCC)cc2)cc1- InChIKey
PKKUYZUMEURUIE-UHFFFAOYSA-N- Molecular formula
- C31H44N2O4
- Average molar mass
- 508.7 g/mol
- Monoisotopic mass
- 508.33010789
Names & identifiers
- Preferred name
- 2-Ethylhexyl 4-((((4-(((2-ethylhexyl)oxy)carbonyl)phenyl)amino)methylene)amino)benzoate
- IUPAC
- 2-ethylhexyl 4-[[4-(2-ethylhexoxycarbonyl)phenyl]iminomethylamino]benzoate
- English name
- 2-ethylhexyl 4-[[[[4-[[(2-ethylhexyl)oxy]carbonyl]phenyl]amino]methylene]amino]benzoate
- Molecular formula
- C31H44N2O4
- Molecular weight
- 508.69206
Names & synonyms
EINECS 278-927-7Benzoic acid, 4-[[[[4-[[(2-ethylhexyl)oxy]carbonyl]phenyl]amino]methylene]amino]-, 2-ethylhexyl esterDTXSID208885492-Ethylhexyl 4-((((4-(((2-ethylhexyl)oxy)carbonyl)phenyl)amino)methylene)amino)benzoateBenzoic acid, 4-((((4-(((2-ethylhexyl)oxy)carbonyl)phenyl)amino)methylene)amino)-, 2-ethylhexyl ester2-ethylhexyl 4-[[[[4-[[(2-ethylhexyl)oxy]carbonyl]phenyl]amino]methylene]amino]benzoateRefChem:260682DTXCID901027826278-927-778480-23-6PKKUYZUMEURUIE-UHFFFAOYSA-NNS00058468
Show more names
4-[[[[4-[[(2-Ethylhexyl)oxy]carbonyl]phenyl]amino]methylene]amino]benzoic acid 2-ethylhexyl ester
2-Ethylhexyl 4-{[(4-{[(2-ethylhexyl)oxy]carbonyl}anilino)methylidene]amino}benzoate
Database identifiers
- CAS
78480-23-6- PubChem CID
- 174142
- DTXSID
DTXSID20888549- EC Number
- 278-927-7
- Nikkaji
- J319.773E
Properties
Computed structural properties
- XLogP
- 8.9
- Topological polar surface area
- 77 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 19
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 652
Physicochemical properties
- EPA Substance Registry System
- 4 · Benzoic acid, 4-[[[[4-[[(2-ethylhexyl)oxy]carbonyl]phenyl]amino]methylene]amino]-, 2-ethylhexyl ester (78480-23-6)
- 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.
Hazard information
Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzoic acid, 4-[[[[4-[[(2-ethylhexyl)oxy]carbonyl]phenyl]amino]methylene]amino]-, 2-ethylhexyl ester: INACTIVE
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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