(2S)-2-Amino-5-(Diaminomethylideneamino)Pentanoic Acid, 2-Sulfanylethanesulfonic Acid
[CAS# 106854-46-0]

Identification

• Name: (2S)-2-Amino-5-(Diaminomethylideneamino)Pentanoic Acid, 2-Sulfanylethanesulfonic Acid
• Synonyms: (2S)-2-Amino-5-Guanidino-Pentanoic Acid; 2-Sulfanylethanesulfonic Acid; (2S)-2-Amino-5-Guanidinopentanoic Acid; 2-Mercaptoethanesulfonic Acid; (2S)-2-Amino-5-Guanidino-Valeric Acid; 2-Mercaptoethanesulfonic Acid
• Molecular Formula: C₈H₂₀N₄O₅S₂
• Molecular Weight: 316.39
• CAS Registry Number: 106854-46-0
• SMILES: [C@H](N)(CCCN=C(N)N)C(O)=O.C([S](O)(=O)=O)CS
• InChI: 1S/C6H14N4O2.C2H6O3S2/c7-4(5(11)12)2-1-3-10-6(8)9;3-7(4,5)2-1-6/h4H,1-3,7H2,(H,11,12)(H4,8,9,10);6H,1-2H2,(H,3,4,5)/t4-;/m0./s1
• InChIKey: MZDDDSNBRVMDIH-WCCKRBBISA-N

Properties

• Boiling point: 409.1°C at 760 mmHg (Cal.)
• Flash point: 201.2°C (Cal.)