Cas no 51305-11-4 (1,3,5-Triazine-2,4-diamine, N,N'-dicyclohexyl-6-methoxy-)
51305-11-4 structure
Product Name:1,3,5-Triazine-2,4-diamine, N,N'-dicyclohexyl-6-methoxy-
CAS No:51305-11-4
MF:C16H27N5O
MW:305.418483018875
CID:362585
PubChem ID:15184089
Update Time:2025-04-19
1,3,5-Triazine-2,4-diamine, N,N'-dicyclohexyl-6-methoxy- Chemical and Physical Properties
Names and Identifiers
-
- 1,3,5-Triazine-2,4-diamine, N,N'-dicyclohexyl-6-methoxy-
- 2-N,4-N-dicyclohexyl-6-methoxy-1,3,5-triazine-2,4-diamine
- 51305-11-4
- Oprea1_762983
- DTXSID40569762
- N~2~,N~4~-Dicyclohexyl-6-methoxy-1,3,5-triazine-2,4-diamine
-
- Inchi： 1S/C16H27N5O/c1-22-16-20-14(17-12-8-4-2-5-9-12)19-15(21-16)18-13-10-6-3-7-11-13/h12-13H,2-11H2,1H3,(H2,17,18,19,20,21)
- InChI Key： ITAAPKASCNLKFJ-UHFFFAOYSA-N
- SMILES： O(C)C1=NC(=NC(=N1)NC1CCCCC1)NC1CCCCC1
Computed Properties
- Exact Mass: 305.22181
- Monoisotopic Mass: 305.22156050g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 22
- Rotatable Bond Count: 5
- Complexity: 290
- 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: 4.5
- Topological Polar Surface Area: 72?2
Experimental Properties
- PSA: 71.96
1,3,5-Triazine-2,4-diamine, N,N'-dicyclohexyl-6-methoxy- Related Literature
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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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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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