Cas no 17806-42-7 ((2S)-2-amino-5-(diaminomethylideneazaniumyl)pentanoate)

(2S)-2-amino-5-(diaminomethylideneazaniumyl)pentanoate structure
17806-42-7 structure
Product Name:(2S)-2-amino-5-(diaminomethylideneazaniumyl)pentanoate
CAS No:17806-42-7
MF:C6H14N4O2
MW:174.200960636139
CID:2724642
Update Time:2023-08-07

(2S)-2-amino-5-(diaminomethylideneazaniumyl)pentanoate Chemical and Physical Properties

Names and Identifiers

    • (2S)-2-amino-5-(diaminomethylideneazaniumyl)pentanoate
    • CPSS
    • Protonated arginine
    • 2-Propenoic acid, 2-methyl-, monoester with 1,2-propanediol, polymer with ethyl 2-propenoate and 2-p
    • ARGININE, CONJUGATE MONOACID, L-
    • Inchi: 1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m0/s1
    • InChI Key: ODKSFYDXXFIFQN-BYPYZUCNSA-N
    • SMILES: [O-]C([C@H](CCC/[NH+]=C(\N)/N)N)=O

Computed Properties

  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 4
  • Complexity: 171
  • XLogP3: -3.5
  • Topological Polar Surface Area: 132
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