Cas no 103427-81-2 (1,3,5-Triazine-2,4-diamine,6-[(difluoromethyl)thio]-N2-(1,2-dimethylpropyl)-N4-(1-methylethyl)-)
103427-81-2 structure
Product Name:1,3,5-Triazine-2,4-diamine,6-[(difluoromethyl)thio]-N2-(1,2-dimethylpropyl)-N4-(1-methylethyl)-
CAS No:103427-81-2
MF:C12H21F2N5S
MW:305.390447378159
CID:228579
PubChem ID:190527
Update Time:2025-04-19
1,3,5-Triazine-2,4-diamine,6-[(difluoromethyl)thio]-N2-(1,2-dimethylpropyl)-N4-(1-methylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1,3,5-Triazine-2,4-diamine,6-[(difluoromethyl)thio]-N2-(1,2-dimethylpropyl)-N4-(1-methylethyl)-
- 1,3,5-Triazine-2,4-diamine,6-[(difluoromethyl)thio]-N-(1,2-dimethylpropyl)-N'-(1-methylethyl)- (9CI)
- 6-(difluoromethylsulfanyl)-2-N-(3-methylbutan-2-yl)-4-N-propan-2-yl-1,3,5-triazine-2,4-diamine
- DTXSID60908396
- 103427-81-2
- 6-[(Difluoromethyl)sulfanyl]-N~2~-(3-methylbutan-2-yl)-N~4~-(propan-2-yl)-1,3,5-triazine-2,4(1H,3H)-diimine
- 1,3,5-Triazine-2,4-diamine, 6-((difluoromethyl)thio)-N-(1,2-dimethylpropyl)-N'-(1-methylethyl)-
-
- Inchi: 1S/C12H21F2N5S/c1-6(2)8(5)16-11-17-10(15-7(3)4)18-12(19-11)20-9(13)14/h6-9H,1-5H3,(H2,15,16,17,18,19)
- InChI Key: JNLXRRLOMHKRIC-UHFFFAOYSA-N
- SMILES: S(C(F)F)C1N=C(N=C(N=1)NC(C)C(C)C)NC(C)C
Computed Properties
- Exact Mass: 305.14883
- Monoisotopic Mass: 305.149
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 20
- Rotatable Bond Count: 7
- Complexity: 281
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 5.2
- Topological Polar Surface Area: 88?2
Experimental Properties
- Density: 1.18
- Boiling Point: 395.3°Cat760mmHg
- Flash Point: 192.8°C
- Refractive Index: 1.512
- PSA: 62.73
- LogP: 2.30680
1,3,5-Triazine-2,4-diamine,6-[(difluoromethyl)thio]-N2-(1,2-dimethylpropyl)-N4-(1-methylethyl)- Related Literature
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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