Cas no 153635-76-8 (6-[(4-Amino-6-chloro-1,3,5-triazin-2-YL)amino]hexanoic acid)
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
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- 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
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- 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
6-[(4-Amino-6-chloro-1,3,5-triazin-2-YL)amino]hexanoic acid Related Literature
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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