Cas no 15821-36-0 (1,3,5-Triazine-2,4-diamine,6-(3-buten-1-yl)-)
15821-36-0 structure
Product Name:1,3,5-Triazine-2,4-diamine,6-(3-buten-1-yl)-
1,3,5-Triazine-2,4-diamine,6-(3-buten-1-yl)- Chemical and Physical Properties
Names and Identifiers
-
- 1,3,5-Triazine-2,4-diamine,6-(3-buten-1-yl)-
- 6-(but-3-en-1-yl)-1,3,5-triazine-2,4-diamine
- 6-but-3-enyl-1,3,5-triazine-2,4-diamine
- 1,3,5-Triazine-2,4-diamine, 6-(3-butenyl)-
- s-Triazine, 2,4-diamino-6-(3-butenyl)-
- SCHEMBL11400328
- NS00025142
- 1,3,5-Triazine-2,4-diamine, 6-(3-buten-1-yl)-
- DTXSID8065951
- 15821-36-0
- EINECS 239-918-3
-
- Inchi： 1S/C7H11N5/c1-2-3-4-5-10-6(8)12-7(9)11-5/h2H,1,3-4H2,(H4,8,9,10,11,12)
- InChI Key： NUIMPSFZBALNHW-UHFFFAOYSA-N
- SMILES： N1C(N)=NC(N)=NC=1CCC=C
Computed Properties
- Exact Mass: 165.10163
- Monoisotopic Mass: 165.101
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 139
- 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
- Topological Polar Surface Area: 90.7A^2
- XLogP3: 0.7
Experimental Properties
- Density: 1.227
- Boiling Point: 424°C at 760 mmHg
- Flash Point: 239.8°C
- Refractive Index: 1.624
- PSA: 90.71
1,3,5-Triazine-2,4-diamine,6-(3-buten-1-yl)- Related Literature
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
15821-36-0 (1,3,5-Triazine-2,4-diamine,6-(3-buten-1-yl)-) Related Products
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