Cas no 2715-73-3 (9H-Purin-6-amine,9-heptyl-)
9H-Purin-6-amine,9-heptyl- structure
Product Name:9H-Purin-6-amine,9-heptyl-
CAS No:2715-73-3
MF:C12H19N5
MW:233.312761545181
CID:281457
PubChem ID:348239
Update Time:2025-04-19
9H-Purin-6-amine,9-heptyl- Chemical and Physical Properties
Names and Identifiers
-
- 9H-Purin-6-amine,9-heptyl-
- 9-heptylpurin-6-amine
- 9-Heptyl-6-amino-9H-purin
- 9-heptyl-9H-purin-6-ylamine
- AC1L893Y
- NSC407422
- SCHEMBL23228230
- NSC-407422
- 2715-73-3
- AKOS012922661
- DTXSID60324658
- NSC 407422
- 9-Heptyl-9H-purin-6-amine
-
- Inchi： 1S/C12H19N5/c1-2-3-4-5-6-7-17-9-16-10-11(13)14-8-15-12(10)17/h8-9H,2-7H2,1H3,(H2,13,14,15)
- InChI Key： WYQFWKDBSKQIOG-UHFFFAOYSA-N
- SMILES： N1(C=NC2=C(N)N=CN=C12)CCCCCCC
Computed Properties
- Exact Mass: 233.16427
- Monoisotopic Mass: 233.16404563g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 6
- Complexity: 223
- 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: 2.9
- Topological Polar Surface Area: 69.6?2
Experimental Properties
- PSA: 69.62
- LogP: 2.96010
9H-Purin-6-amine,9-heptyl- 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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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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