Dibutyl 2,2'-azanediyldiacetate
Basic information
- CAS
53743-59-2- Standard SMILES
CCCCOC(=O)CNCC(=O)OCCCC- InChIKey
OXGRNSCFYSJLFX-UHFFFAOYSA-N- Molecular formula
- C12H23NO4
- Average molar mass
- 245.32 g/mol
- Monoisotopic mass
- 245.16270821
Names & identifiers
- Preferred name
- Dibutyl 2,2'-azanediyldiacetate
- IUPAC
- butyl 2-[(2-butoxy-2-oxoethyl)amino]acetate
Names & synonyms
53743-59-2NSC370796SCHEMBL8390835SCHEMBL8390838Dibutyl 2,2'-azanediyldiacetateDTXSID80321129NSC-370796
Database identifiers
- CAS
53743-59-2- PubChem CID
- 340336
- DTXSID
DTXSID80321129
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 12
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 197
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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