Cas no 3366-22-1 (6-(6-aminopurin-9-yl)-3,4,5-trihydroxyoxane-2-carboxamide)
3366-22-1 structure
Product Name:6-(6-aminopurin-9-yl)-3,4,5-trihydroxyoxane-2-carboxamide
CAS No:3366-22-1
MF:C11H14N6O5
MW:310.266061306
CID:1459305
PubChem ID:257005
Update Time:2025-04-20
6-(6-aminopurin-9-yl)-3,4,5-trihydroxyoxane-2-carboxamide Chemical and Physical Properties
Names and Identifiers
-
- 6-(6-aminopurin-9-yl)-3,4,5-trihydroxyoxane-2-carboxamide
- AC1L5VTR
- 6-(6-amino-9h-purin-9-yl)-3,4,5-trihydroxytetrahydro-2h-pyran-2-carboxamide(non-preferred name)
- AR-1G9859
- 6-(6-amino-9H-purin-9-yl)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxamide (non-preferred name)
- NSC84631
- AC1Q5J53
- AC1L5VTR; 6-(6-amino-9h-purin-9-yl)-3,4,5-trihydroxytetrahydro-2h-pyran-2-carboxamide(non-preferred name); AR-1G9859; 6-(6-amino-9H-purin-9-yl)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxamide (non-preferred name); NSC84631; AC1Q5J53;
- DTXSID20292687
- NSC-84631
- 3366-22-1
- 6-(6-Amino-9H-purin-9-yl)-3,4,5-trihydroxyoxane-2-carboxamide
-
- Inchi： 1S/C11H14N6O5/c12-8-3-10(15-1-14-8)17(2-16-3)11-6(20)4(18)5(19)7(22-11)9(13)21/h1-2,4-7,11,18-20H,(H2,13,21)(H2,12,14,15)
- InChI Key： FEPGTBWMHXJGJG-UHFFFAOYSA-N
- SMILES： O1C(C(N)=O)C(C(C(C1N1C=NC2C(N)=NC=NC1=2)O)O)O
Computed Properties
- Exact Mass: 310.10272
- Monoisotopic Mass: 310.103
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 5
- Hydrogen Bond Acceptor Count: 9
- Heavy Atom Count: 22
- Rotatable Bond Count: 2
- Complexity: 441
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 5
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: _2.1
- Topological Polar Surface Area: 183?2
Experimental Properties
- Density: 2.24
- Boiling Point: 807.7°C at 760 mmHg
- Flash Point: 442.3°C
- Refractive Index: 1.961
- PSA: 182.63
- LogP: -1.84460
6-(6-aminopurin-9-yl)-3,4,5-trihydroxyoxane-2-carboxamide Related Literature
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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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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
3366-22-1 (6-(6-aminopurin-9-yl)-3,4,5-trihydroxyoxane-2-carboxamide) Related Products
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