Basic information
- CAS
58558-59-1- Standard SMILES
O=C(O)CCCCCN(CC(=O)O)CC(=O)O- InChIKey
IPPPTEJXHANHIR-UHFFFAOYSA-N- Molecular formula
- C10H17NO6
- Average molar mass
- 247.24 g/mol
- Monoisotopic mass
- 247.10558726
Names & identifiers
- Preferred name
- 6-[Bis(carboxymethyl)amino]hexanoic acid
- IUPAC
- 6-[bis(carboxymethyl)amino]hexanoic acid
Names & synonyms
6-[BIS(CARBOXYMETHYL)AMINO]HEXANOIC ACID58558-59-1SCHEMBL15549398DTXSID50532482
Database identifiers
- CAS
58558-59-1- PubChem CID
- 13257587
- DTXSID
DTXSID50532482- Nikkaji
- J2.099.704D
Properties
Computed structural properties
- XLogP
- -2.3
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 10
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 262
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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