Molecular properties
- Formula
- C12H14O4
- Molar mass
- 222.24 g·mol−1
- Exact mass
- 222.0892 Da
- 6
- PubChem CID
- 12483
Molecule record
diethyl benzene-1,4-dicarboxylate
C12H14O4
222.24 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Aromatic ring
Ester
Ether
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 1,4-Benzenedicarboxylic acid, 1,4-diethyl ester
- 1,4-Benzenedicarboxylic acid, diethyl ester
- 1,4-diethyl benzene-1,4-dicarboxylate
- 211-249-1
- 636-09-9
- AI3-10015
- BRN 0650906
- DIETHYL TEREPHTHALATE
Show all 24 synonyms
- DTXCID6044014
- DTXSID8060909
- Diethyl p-phthalate
- EINECS 211-249-1
- Ethyl terephthalate
- MFCD00039891
- N97X85L3CD
- NSC-68816
- RefChem:133450
- SCHEMBL87450
- Terephthalic acid, diethyl ester
- UNII-N97X85L3CD
- diethyl 1,4-benzenedioate
- orb1705687
- orb3025668
- p-Diethyl phthalate
Structure identifiers
- Canonical SMILES
- CCOC(=O)c1ccc(C(=O)OCC)cc1
- Isomeric SMILES
- CCOC(=O)C1=CC=C(C=C1)C(=O)OCC
- InChI
- InChI=1S/C12H14O4/c1-3-15-11(13)9-5-7-10(8-6-9)12(14)16-4-2/h5-8H,3-4H2,1-2H3
- InChIKey
- ONIHPYYWNBVMID-UHFFFAOYSA-N
- PubChem CID
- 12483
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for diethyl benzene-1,4-dicarboxylate; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for diethyl benzene-1,4-dicarboxylate; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.