Cas no 1089-92-5 (7H-Purine-2,8-diamine,7-ribofuranosyl- (9CI))
1089-92-5 structure
Product Name:7H-Purine-2,8-diamine,7-ribofuranosyl- (9CI)
CAS No:1089-92-5
MF:C10H14N6O4
MW:282.255960941315
CID:181538
PubChem ID:118984353
Update Time:2025-04-19
7H-Purine-2,8-diamine,7-ribofuranosyl- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 7H-Purine-2,8-diamine,7-ribofuranosyl- (9CI)
- 1089-92-5
- 7-Ribofuranosyl-7H-purine-2,8-diamine
- 7H-Purine-2,8-diamine, 7-ribofuranosyl-
-
- Inchi： 1S/C10H14N6O4/c11-9-13-1-3-7(14-9)15-10(12)16(3)8-6(19)5(18)4(2-17)20-8/h1,4-6,8,17-19H,2H2,(H4,11,12,13,14,15)/t4-,5-,6-,8-/m1/s1
- InChI Key： QWYMPTSCUFKJML-UAKXSSHOSA-N
- SMILES： O1[C@H](CO)[C@H]([C@H]([C@@H]1N1C(N)=NC2C1=CN=C(N)N=2)O)O
Computed Properties
- Exact Mass: 282.10782
- Monoisotopic Mass: 282.10765295g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 5
- Hydrogen Bond Acceptor Count: 9
- Heavy Atom Count: 20
- Rotatable Bond Count: 2
- Complexity: 363
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 4
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -2.3
- Topological Polar Surface Area: 166?2
Experimental Properties
- PSA: 165.56
7H-Purine-2,8-diamine,7-ribofuranosyl- (9CI) Related Literature
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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