N-(2-Amino-1-hydroxyethylidene)threonine
Basic information
- CAS
27174-15-8- Standard SMILES
CC(O)C(NC(=O)CN)C(=O)O- InChIKey
OLIFSFOFKGKIRH-UHFFFAOYSA-N- Molecular formula
- C6H12N2O4
- Average molar mass
- 176.17 g/mol
- Monoisotopic mass
- 176.07970687
Names & identifiers
- Preferred name
- N-(2-Amino-1-hydroxyethylidene)threonine
- IUPAC
- 2-[(2-aminoacetyl)amino]-3-hydroxybutanoic acid
- English name
- Glycyl-DL-threonine
- Molecular formula
- C6H12N2O4
- Molecular weight
- 176.17
Names & synonyms
DTXSID90949914N-(2-Amino-1-hydroxyethylidene)threonineRefChem:1090951DTXCID10926626GLYCYL-DL-THREONINEGlycyl-L-threonine ,2-[(2-aminoacetyl)amino]-3-hydroxybutanoic acidH-Gly-DL-Thr-OHGly-thr2-[(2-amino-1-oxoethyl)amino]-3-hydroxybutanoic acidL-Threonine, N-glycyl-N-(Aminoacetyl)threonine #
Show more names
GLY-DL-THRThreonine, glycyl-N-glycyl-DL-threonineH-Gly-DL-Thr-OH Hydraterel-Glycyl-DL-threonineGLYCYL-DL-THREONINE USP/EP/BPGlycyl-DL-threoninemonohydrateGly-D-Thr-OH/Gly-L-Thr-OH,(1:1)
Glycyl-DL-threonine HydrateGT dipeptideG-T DipeptideL-Glycyl-L-ThreonineMFCD00067443N-(Aminoacetyl)threonineDL-Threonine, N-glycyl-Glycine Threonine dipeptide
Database identifiers
- CAS
27174-15-8- PubChem CID
- 351980
- DTXSID
DTXSID90949914
Properties
Computed structural properties
- XLogP
- -4.1
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 182
Experimental & physicochemical properties
LogP-4.58
Physical DescriptionSolid
Physicochemical properties
- Boiling point
- 486.7 · 486.7±45.0 °C(Predicted)
- Density
- 1.354 · 1.354±0.06 g/cm3(Predicted)
- storage temp.
- -15 °C · -15°C
- pka
- 2.98 · 2.98±0.10(Predicted)
- form
- powder to crystal
- color
- White to Almost white
- CAS DataBase Reference
- 27174 · 27174-15-8(CAS DataBase Reference)
- HS Code
- 2924.19 · 2924.19.1150
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2924.19.1150
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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