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Cas Database |
| Name |
2-Aminoadenosine |
EINECS | 209-610-8 |
| CAS No. | 2096-10-8 | Density | 2.25 g/cm3 |
| PSA | 165.56000 | LogP | -1.23540 |
| Solubility | N/A | Melting Point |
241-243°C (dec.) |
| Formula | C10H14N6O4 | Boiling Point | 798.5 °C at 760 mmHg |
| Molecular Weight | 282.259 | Flash Point | 436.7 °C |
| Transport Information | N/A | Appearance | White powder |
| Safety | 24/25 | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
2-(2,6-diaminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol;2-Amino-adenosine;9H-Purine-2,6-diamine, 9-.beta.-D-ribofuranosyl-;2,6-Diaminopurinosine;Adenosine, 2-amino-;9-beta-Ribosyl-2,6-diaminopurine;(2R,3R,4R,5R)-2-(2,6-diaminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol;9H-Purine, 2,6-diamino-9-beta-D-ribofuranosyl- (8CI);2,6-Diaminonebularine;9H-Purine-2,6-diamine, 9-beta-D-ribofuranosyl-;2-Aminoadenosine, 2,6-Diaminopurine riboside; |
Article Data | 2 |
2-Aminoadenosine Specification
The 2-Aminoadenosine, with the CAS registry number 2096-10-8, has the IUPAC name of 2-(2,6-diaminopurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol. It is a kind of white powder, and belongs to the following product categories: Nucleotides and Nucleosides; Nucleic acids; Bases & Related Reagents. And the molecular formula of the chemical is C10H14N6O4.
The physical properties of 2-Aminoadenosine are as followings: (1)ACD/LogP: -1.08; (2)# of Rule of 5 Violations: 2; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 3.83; (6)ACD/KOC (pH 7.4): 6.1; (7)#H bond acceptors: 10; (8)#H bond donors: 7; (9)#Freely Rotating Bonds: 5; (10)Polar Surface Area: 87 Å2; (11)Index of Refraction: 1.985; (12)Molar Refractivity: 61.87 cm3; (13)Molar Volume: 124.9 cm3; (14)Polarizability: 24.52×10-24cm3; (15)Surface Tension: 127.6 dyne/cm; (16)Density: 2.25 g/cm3; (17)Flash Point: 436.7 °C; (18)Enthalpy of Vaporization: 121.77 kJ/mol; (19)Boiling Point: 798.5 °C at 760 mmHg; (20)Vapour Pressure: 6.73E-27 mmHg at 25°C.
Uses of 2-Aminoadenosine: It can react with acetic acid anhydride to produce N2,N6-diacetyl-2-aminoadenosine. This reaction will need reagent DMAP, and the menstruum pyridine. The reaction time is 3 hours with temperature of 60°C, and the yield is about 41%.
You can still convert the following datas into molecular structure:
(1)SMILES: n2c1c(nc(nc1n(c2)C3OC(C(O)C3O)CO)N)N
(2)InChI: InChI=1/C10H14N6O4/c11-7-4-8(15-10(12)14-7)16(2-13-4)9-6(19)5(18)3(1-17)20-9/h2-3,5-6,9,17-19H,1H2,(H4,11,12,14,15)
(3)InChIKey: ZDTFMPXQUSBYRL-UHFFFAOYAE
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