Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
Adenosine,5'-O-(4,6-dihydroxy-2,4,6-trioxido-1,3,5,2,4,6-trioxatriphosphorinan-2-yl)- |
EINECS | N/A |
CAS No. | 53355-60-5 | Density | 2.78 g/cm3 |
PSA | 277.33000 | LogP | -0.00220 |
Solubility | N/A | Melting Point |
N/A |
Formula | C10H14N5O12P3 | Boiling Point | 831.4 °C at 760 mmHg |
Molecular Weight | 489.169 | Flash Point | 456.6 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Adenosine,5'-O-(4,6-dihydroxy-1,3,5,2,4,6-trioxatriphosphorinan-2-yl)-,P,P',P''-trioxide;1,3,5,2,4,6-Trioxatriphosphorinane, adenosine deriv.;Adenosine 5'-trimetaphosphate;Monoadenosine 5'-trimetaphosphate; |
Article Data | 3 |
The Adenosine,5'-O-(4,6-dihydroxy-2,4,6-trioxido-1,3,5,2,4,6-trioxatriphosphorinan-2-yl)- is an organic compound with the formula C10H14N5O12P3. The systematic name of this chemical is 5'-O-(4,6-dihydroxy-2,4,6-trioxido-1,3,5,2,4,6-trioxatriphosphinan-2-yl)adenosine. With the CAS registry number 53355-60-5, it is also named as Adenosine-5'-trimetaphosphate.
Physical properties about Adenosine,5'-O-(4,6-dihydroxy-2,4,6-trioxido-1,3,5,2,4,6-trioxatriphosphorinan-2-yl)- are: (1)#H bond acceptors: 17; (2)#H bond donors: 6; (3)#Freely Rotating Bonds: 6; (4)Polar Surface Area: 210.55 Å2; (5)Index of Refraction: 1.983; (6)Molar Refractivity: 86.94 cm3; (7)Molar Volume: 175.8 cm3; (8)Polarizability: 34.46×10-24cm3; (9)Surface Tension: 216 dyne/cm; (10)Density: 2.78 g/cm3; (11)Flash Point: 456.6 °C; (12)Enthalpy of Vaporization: 126.64 kJ/mol; (13)Boiling Point: 831.4 °C at 760 mmHg; (14)Vapour Pressure: 2.67E-29 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=P4(O)OP(=O)(OP(=O)(OC[C@H]3O[C@@H](n1c2ncnc(N)c2nc1)[C@H](O)[C@@H]3O)O4)O
(2)InChI: InChI=1/C10H14N5O12P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-30(22)26-28(18,19)25-29(20,21)27-30/h2-4,6-7,10,16-17H,1H2,(H,18,19)(H,20,21)(H2,11,12,13)/t4-,6-,7-,10-/m1/s1
(3)InChIKey: AJXBDVJYPUYBBS-KQYNXXCUBI
(4)Std. InChI: InChI=1S/C10H14N5O12P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-30(22)26-28(18,19)25-29(20,21)27-30/h2-4,6-7,10,16-17H,1H2,(H,18,19)(H,20,21)(H2,11,12,13)/t4-,6-,7-,10-/m1/s1
(5)Std. InChIKey: AJXBDVJYPUYBBS-KQYNXXCUSA-N