2,6-Diamino-6-oxohexanoic acid
Basic information
- CAS
34218-76-3- Standard SMILES
NC(=O)CCCC(N)C(=O)O- InChIKey
YZJSUQQZGCHHNQ-UHFFFAOYSA-N- Molecular formula
- C6H12N2O3
- Average molar mass
- 160.17 g/mol
- Monoisotopic mass
- 160.08479225
Overview
Homoglutamine is an alpha-amino acid.
Names & identifiers
- Preferred name
- 2,6-Diamino-6-oxohexanoic acid
- IUPAC
- 2,6-diamino-6-oxohexanoic acid
- English name
- D,L-Homoglutamine
- Molecular formula
- C6H12N2O3
- Molecular weight
- 160.17
Names & synonyms
D,L-Homoglutamine2,6-diamino-6-oxohexanoic acid34218-76-3Homoglutamine5632-90-6Dl-homoglutamineL-2-Aminoadipamic AcidSCHEMBL3739403SCHEMBL3739405CHEBI:165862DTXSID4013465462,6-diamino-6-keto-hexanoic acid
Show more names
6-OxolysineLysine, 6-oxo-DL-2-amino-adipamicacidDL-5-Carbamoylnorvaline6-Amino-6-oxonorleucine5-(Aminocarbonyl)norvaline*Codeine Phosphate Impurity 9 (Codeine Phosphate EP Impurity I)
DB-230286A7E99C01-FC01-4C87-96C8-A45BB27E33D2
Database identifiers
- CAS
34218-76-3- PubChem CID
- 4153392
- DTXSID
DTXSID401346546- ChEBI
CHEBI:165862
Properties
Computed structural properties
- XLogP
- -3.8
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 158
Physicochemical properties
- Melting point
- 173 · 173-177°C
- Boiling point
- 449.203 · 449.203±40.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.261 · 1.261±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- storage temp.
- Refrigerator
- solubility
- Aqueous Acid (Slightly), Methanol (Very Slightly), Water (Slightly)
- form
- Solid
- pka
- 2.497 · 2.497±0.24(predicted)
- color
- White to Off-White
- CAS DataBase Reference
- 34218 · 34218-76-3
- FDA UNII
- 0 GTA5JB5B · O0GTA5JB5B
Chemistry & industry
Applications
UsesGlutamine analog.
Additional notes
DefinitionChEBI: Homoglutamine is an alpha-amino acid.
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