Cas no 153635-76-8 (6-[(4-Amino-6-chloro-1,3,5-triazin-2-YL)amino]hexanoic acid)

6-[(4-Amino-6-chloro-1,3,5-triazin-2-YL)amino]hexanoic acid structure
153635-76-8 structure
Product Name:6-[(4-Amino-6-chloro-1,3,5-triazin-2-YL)amino]hexanoic acid
CAS No:153635-76-8
MF:C9H14ClN5O2
MW:259.692759990692
CID:2779165
PubChem ID:71346551
Update Time:2025-04-21

6-[(4-Amino-6-chloro-1,3,5-triazin-2-YL)amino]hexanoic acid Chemical and Physical Properties

Names and Identifiers

    • 6-[(4-AMINO-6-CHLORO-1,3,5-TRIAZIN-2-YL)AMINO]HEXANOIC ACID
    • 153635-76-8
    • 6-((4-Amino-6-chloro-1,3,5-triazin-2-yl)amino)hexanoic acid
    • DTXSID40772592
    • 6-((4-Amino-6-chloro-1,3,5-triazin-2-yl)amino)hexanoicacid
    • 6-[(4-Amino-6-chloro-1,3,5-triazin-2-YL)amino]hexanoic acid
    • Inchi: 1S/C9H14ClN5O2/c10-7-13-8(11)15-9(14-7)12-5-3-1-2-4-6(16)17/h1-5H2,(H,16,17)(H3,11,12,13,14,15)
    • InChI Key: QUAHYQYPVLAJST-UHFFFAOYSA-N
    • SMILES: ClC1N=C(N)N=C(N=1)NCCCCCC(=O)O

Computed Properties

  • Exact Mass: 259.0836024Da
  • Monoisotopic Mass: 259.0836024Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 7
  • Complexity: 243
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.5
  • Topological Polar Surface Area: 114?2
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