1-[(2r)-6-Amino-2-(l-threonylamino)hex-4-ynoyl]-l-proline

Base Information

• Chemical Name: 1-[(2r)-6-Amino-2-(l-threonylamino)hex-4-ynoyl]-l-proline
• CAS No.: 92837-05-3
• Molecular Formula: C15H24N4O5
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID40918933
• Wikidata: Q82891285
• Mol file: 92837-05-3.mol

Synonyms:Thr-Dah-Pro;threonyl-(2,6-diamino-4-hexynoate)proline;threonyl-2,6-diamino-4-hexynoate proline

Chemical Property of 1-[(2r)-6-Amino-2-(l-threonylamino)hex-4-ynoyl]-l-proline

Chemical Property:

• Vapor Pressure: 8.38E-25mmHg at 25°C
• Boiling Point: 733°C at 760 mmHg
• Flash Point: 397.1°C
• PSA: 158.98000
• Density: 1.358g/cm³
• LogP: -0.66350
• XLogP3: -5.6
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 6
• Exact Mass: 340.17466988
• Heavy Atom Count: 24
• Complexity: 553

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: CC(C(C(=O)NC(CC#CCN)C(=O)N1CCCC1C(=O)O)N)O
• Isomeric SMILES: C[C@H]([C@@H](C(=O)N[C@H](CC#CCN)C(=O)N1CCC[C@H]1C(=O)O)N)O

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