Basic information
- CAS
5867-18-5- Standard SMILES
COc1ccc(C(=O)CC(=O)Nc2cc(C(=O)O)ccc2OC)cc1- InChIKey
ODEIFSHWKMXEGJ-UHFFFAOYSA-N- Molecular formula
- C18H17NO6
- Average molar mass
- 343.3 g/mol
- Monoisotopic mass
- 343.10558726
Names & identifiers
- Preferred name
- 4-Methoxy-3-[[3-(4-methoxyphenyl)-1,3-dioxopropyl]amino]benzoic acid
- IUPAC
- 4-methoxy-3-[[3-(4-methoxyphenyl)-3-oxopropanoyl]amino]benzoic acid
- English name
- 4-methoxy-3-[[3-(4-methoxyphenyl)-1,3-dioxopropyl]amino]benzoic acid
- Molecular formula
- C18H17NO6
- Molecular weight
- 343.33068
Names & synonyms
5867-18-54-METHOXY-3-[[3-(4-METHOXYPHENYL)-1,3-DIOXOPROPYL]AMINO]BENZOIC ACID4-Methoxy-3-((3-(4-methoxyphenyl)-1,3-dioxopropyl)amino)benzoic acidEINECS 227-518-1DTXSID00207370RefChem:99587DTXCID00129861227-518-189E2ND3XC9ODEIFSHWKMXEGJ-UHFFFAOYSA-N4-METHOXY-3-[3-(4-METHOXYPHENYL)-3-OXOPROPANAMIDO]BENZOIC ACIDDB-325051
Show more names
4-methoxy-3-[[3-(4-methoxyphenyl)-3-oxopropanoyl]amino]benzoic acid
p-Anisic acid, 3-(2-p-anisoylacetamido)-NS00033989Benzoic acid, 4-methoxy-3-[[3-(4-methoxyphenyl)-1,3-dioxopropyl]amino]-4-METHOXY-3-[[3-(4-METHOXYPHENYL)-1,3-DIOXOPROPYL ]AMINO]BENZOIC ACID
Database identifiers
- CAS
5867-18-5- PubChem CID
- 79977
- DTXSID
DTXSID00207370- UNII
- 89E2ND3XC9
- EC Number
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 486
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
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 InformationChemical: Benzoic acid, 4-methoxy-3-((3-(4-methoxyphenyl)-1,3-dioxopropyl)amino)-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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