Basic information
- CAS
5344-77-4- Standard SMILES
CC(C)(CO)N(CC(=O)O)CC(=O)O- InChIKey
MTWJNHPLNCMQCM-UHFFFAOYSA-N- Molecular formula
- C8H15NO5
- Average molar mass
- 205.21 g/mol
- Monoisotopic mass
- 205.09502258
Names & identifiers
- Preferred name
- [(2-Hydroxy-1,1-dimethylethyl)imino]diacetic acid
- IUPAC
- 2-[carboxymethyl-(1-hydroxy-2-methylpropan-2-yl)amino]acetic acid
Names & synonyms
5344-77-4NSC1160[(2-HYDROXY-1,1-DIMETHYLETHYL)IMINO]DIACETIC ACIDDTXSID00277210NSC-11602,2'-[(1-Hydroxy-2-methylpropan-2-yl)azanediyl]diacetic acid
Database identifiers
- CAS
5344-77-4- PubChem CID
- 219632
- DTXSID
DTXSID00277210
Properties
Computed structural properties
- XLogP
- -2.9
- Topological polar surface area
- 98.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 210
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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