Basic information
- CAS
36339-61-4- Standard SMILES
COCCOC(=O)c1ccccc1C(=O)OC- InChIKey
DRYXMSSOAFCHRL-UHFFFAOYSA-N- Molecular formula
- C12H14O5
- Average molar mass
- 238.24 g/mol
- Monoisotopic mass
- 238.08412354
Names & identifiers
- Preferred name
- 2-Methoxyethyl methyl benzene-1,2-dicarboxylate
- IUPAC
- 2-O-(2-methoxyethyl) 1-O-methyl benzene-1,2-dicarboxylate
Names & synonyms
36339-61-42-methoxyethyl methyl benzene-1,2-dicarboxylateNSC679892-Methoxyethyl methyl phthalateSCHEMBL12377229DTXSID10290319DRYXMSSOAFCHRL-UHFFFAOYSA-NNSC-67989AKOS0078483821,2-Benzenedicarboxylic acid, 2-methoxyethyl methyl ester
Database identifiers
- CAS
36339-61-4- PubChem CID
- 249554
- DTXSID
DTXSID10290319
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 264
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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