Basic information
- CAS
6754-98-9- Standard SMILES
COc1ccccc1C(=O)OCC(=O)N(C)C- InChIKey
RHBSARBDEDXWOB-UHFFFAOYSA-N- Molecular formula
- C12H15NO4
- Average molar mass
- 237.25 g/mol
- Monoisotopic mass
- 237.10010796
Names & identifiers
- Preferred name
- o-Anisic acid, ester with N,N-dimethylglycolamide
- IUPAC
- [2-(dimethylamino)-2-oxoethyl] 2-methoxybenzoate
Names & synonyms
6754-98-9o-Anisic acid, ester with N,N-dimethylglycolamideDTXSID00217873RefChem:366370DTXCID501403642-(Dimethylamino)-2-oxoethyl 2-methoxybenzoate[2-(dimethylamino)-2-oxoethyl] 2-methoxybenzoateMOAMSCHEMBL30286844
Database identifiers
- CAS
6754-98-9- PubChem CID
- 201759
- DTXSID
DTXSID00217873- Nikkaji
- J3.679.023G
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 278
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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