Cas no 1907-59-1 (4-ethoxy-6-ethyl-1,3,5-triazin-2-amine)
1907-59-1 structure
Product Name:4-ethoxy-6-ethyl-1,3,5-triazin-2-amine
CAS No:1907-59-1
MF:C7H12N4O
MW:168.196380615234
CID:1383940
PubChem ID:121205
Update Time:2025-04-20
4-ethoxy-6-ethyl-1,3,5-triazin-2-amine Chemical and Physical Properties
Names and Identifiers
-
- 4-ethoxy-6-ethyl-1,3,5-triazin-2-amine
- BRN 0609538
- 1907-59-1
- 1,3,5-Triazin-2-amine, 4-ethoxy-6-ethyl-
- DTXSID70172566
-
- Inchi： 1S/C7H12N4O/c1-3-5-9-6(8)11-7(10-5)12-4-2/h3-4H2,1-2H3,(H2,8,9,10,11)
- InChI Key： QCOXTBBBRFLCJK-UHFFFAOYSA-N
- SMILES： O(CC)C1=NC(N)=NC(CC)=N1
Computed Properties
- Exact Mass: 168.10126
- Monoisotopic Mass: 168.101
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 133
- 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: 1.1
- Topological Polar Surface Area: 73.9?2
Experimental Properties
- Density: 1.162
- Boiling Point: 355.7°C at 760 mmHg
- Flash Point: 168.9°C
- Refractive Index: 1.543
- PSA: 73.92
4-ethoxy-6-ethyl-1,3,5-triazin-2-amine Related Literature
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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