1,4-Benzenedicarboxylic acid, 2-(4-(diethylamino)-2-hydroxybenzoyl)-
Basic information
- CAS
52716-31-1- Standard SMILES
CCN(CC)c1ccc(C(=O)c2cc(C(=O)O)ccc2C(=O)O)c(O)c1- InChIKey
QZQLZSOVLJRVIK-UHFFFAOYSA-N- Molecular formula
- C19H19NO6
- Average molar mass
- 357.4 g/mol
- Monoisotopic mass
- 357.12123733
Names & identifiers
- Preferred name
- 1,4-Benzenedicarboxylic acid, 2-(4-(diethylamino)-2-hydroxybenzoyl)-
- IUPAC
- 2-[4-(diethylamino)-2-hydroxybenzoyl]terephthalic acid
- English name
- 2-[4-(Diethylamino)-2-hydroxybenzoyl]-1,4-benzenedicarboxylic acid
- Molecular formula
- C19H19NO6
- Molecular weight
- 357.36
Names & synonyms
2-(4-Diethylamino-2-hydroxybenzoyl)-1,4-benzenedicarboxylic acid1,4-Benzenedicarboxylic acid, 2-(4-(diethylamino)-2-hydroxybenzoyl)-1,4-Benzenedicarboxylic acid, 2-[4-(diethylamino)-2-hydroxybenzoyl]-RefChem:41604152716-31-12-(4-Diethylamino-2-hydroxybenzoyl)terephthalic acid2-[4-(diethylamino)-2-hydroxybenzoyl]benzene-1,4-dicarboxylic acidDTXSID9068792QZQLZSOVLJRVIK-UHFFFAOYSA-NDB-3236482-[4-(DIETHYLAMINO)-2-HYDROXYBENZOYL ]-1,4-BENZENEDICARBOXYLIC ACID2-[4-(Diethylamino)-2-hydroxybenzoyl]-1,4-benzenedicarboxylic acid
Database identifiers
- CAS
52716-31-1- PubChem CID
- 104297
- DTXSID
DTXSID9068792- Nikkaji
- J429.192A
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 532
Physicochemical properties
- EPA Substance Registry System
- 2 · 2-(4-Diethylamino-2-hydroxybenzoyl)terephthalic acid (52716-31-1)
- 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
Uses & manufacturing
General Manufacturing Information1,4-Benzenedicarboxylic acid, 2-[4-(diethylamino)-2-hydroxybenzoyl]-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…