Dimethyl 5-(ethylamino)benzene-1,3-dicarboxylate
Basic information
- CAS
91642-10-3- Standard SMILES
CCNc1cc(C(=O)OC)cc(C(=O)OC)c1- InChIKey
ONNUJBXNPZTHNE-UHFFFAOYSA-N- Molecular formula
- C12H15NO4
- Average molar mass
- 237.25 g/mol
- Monoisotopic mass
- 237.10010796
Names & identifiers
- Preferred name
- Dimethyl 5-(ethylamino)benzene-1,3-dicarboxylate
- IUPAC
- dimethyl 5-(ethylamino)benzene-1,3-dicarboxylate
Names & synonyms
dimethyl 5-(ethylamino)benzene-1,3-dicarboxylate91642-10-3DTXSID802839901,3-benzenedicarboxylic acid, 5-(ethylamino)-, dimethyl esterRefChem:338630DTXCID30235141ONNUJBXNPZTHNE-UHFFFAOYSA-NNSC34722SCHEMBL23668746NSC-34722AKOS006193640
Database identifiers
- CAS
91642-10-3- PubChem CID
- 234585
- DTXSID
DTXSID80283990- Nikkaji
- J2.783.250D
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 256
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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