o-Toluic acid, ester with N,N-diethylglycolamide
Basic information
- CAS
6755-00-6- Standard SMILES
CCN(CC)C(=O)COC(=O)c1ccccc1C- InChIKey
BPSNFPPAMWTSNU-UHFFFAOYSA-N- Molecular formula
- C14H19NO3
- Average molar mass
- 249.3 g/mol
- Monoisotopic mass
- 249.13649347
Names & identifiers
- Preferred name
- o-Toluic acid, ester with N,N-diethylglycolamide
- IUPAC
- [2-(diethylamino)-2-oxoethyl] 2-methylbenzoate
Names & synonyms
o-Toluic acid, ester with N,N-diethylglycolamideGlycolamide, N,N-diethyl-, o-toluate (ester)6755-00-6DTXSID60217879RefChem:366575DTXCID601403702-(Diethylamino)-2-oxoethyl 2-methylbenzoate
Database identifiers
- CAS
6755-00-6- PubChem CID
- 201761
- DTXSID
DTXSID60217879
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 287
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…