C11H15N5O4 Adenosine, 2 '-o-methyl- (7ci, 8ci, 9ci, ACI)
Àireamh Clàrs Cas
2140-79-6
Prìomh thogalaichean corporra | Luach | Suidheachadh |
Cuideam molecular | 281.27 | - |
Puing leaghte (deuchainneach) | 204-206 ° C. | - |
Puing goil (ro-innse) | 623.8 ± 65.0 ° C. | Brùth: 760 Torr |
Dùmhlachd (ro-innse) | 1.84 ± 0.1 G / cm3 | Temp: 20 ° C; Brùth: 760 Torr |
paka (ro-innse) | 13.13 ± 0.70 | Temp as searbhagach: 25 ° C. |
Smiles Canonical
Occ1oc (N2C = NC = 3c (= NC = NC = Nc32) n) c (OC) C1o
Gàire isomicic
O (c) [C @ B @B] 1 [C @2c = 3c (n = c2) = C2) {C2) = C.
Inchi
Inchi = 1s / C11H15N5O4 / C1-19-8-7 (18-17-9 (6-, 7-, 11- / S1
Iuchair Inchi
Fpgcisolxnppcccccccccccca-n
2 ainm eile airson an stuth seo
2 '-O-Myladesadine (ACI); Cordalla b
Togalaichean rim faighinn
Thermal
Seilbh | Luach | Stòr cumhachd |
Puing leaghaidh | 204-206 ° C. | (1) cas |
(1) Martinez-Montero, Saul; Iris Eòrpa Ceimigeachd Organach, (2009) (2009) (1925-3271, S3265 / 1-S3265 / 23 .2-S3265 / 23
Spectra ri fhaighinn
1 h nmr
13 c nmr
IR
Maise
Togalaichean rim faighinn
Bith-eòlasach
Ceimigeach
Dùmhlachd
Lipinski
Structar co-cheangailte
Thermal
Seilbh | Luach | Suidheachadh | Stòr |
Dà fhaclan bith-eòlasach | 1.0 | Ph 1; Temp: 25 ° C. | (1) ACD |
Dà fhaclan bith-eòlasach | 1.0 | Ph 2; Temp: 25 ° C. | (1) ACD |
Dà fhaclan bith-eòlasach | 1.0 | Ph 3; Temp: 25 ° C. | (1) ACD |
Dà fhaclan bith-eòlasach | 1.0 | Ph 4; Temp: 25 ° C. | (1) ACD |
Dà fhaclan bith-eòlasach | 1.78 | Ph 5; Temp: 25 ° C. | (1) ACD |
Dà fhaclan bith-eòlasach | 1.97 | Ph 6; Temp: 25 ° C. | (1) ACD |
Dà fhaclan bith-eòlasach | 1.99 | Ph 7; Temp: 25 ° C. | (1) ACD |
Dà fhaclan bith-eòlasach | 1.99 | Ph 8; Temp: 25 ° C. | (1) ACD |
Dà fhaclan bith-eòlasach | 1.99 | Ph 9; Temp: 25 ° C. | (1) ACD |
Stòr suidheachadh luach seilbh |
Bith-eòlas bàillidh 1.99 PH 10; Temp: 25 ° C (1) ACD |
(1) Air a thomhas a 'cleachdadh leasachadh ceimigeachd adhartach (ACD / LABS) Bathar-bog V11.02 (© 1994-2023 ACD / LAìoban)
Seilbh | Luach | Suidheachadh | Stòr |
Koc | 1.0 | Ph 1; Temp: 25 ° C. | (1) ACD |
Koc | 1.0 | Ph 2; Temp: 25 ° C. | (1) ACD |
Koc | 4.54 | Ph 3; Temp: 25 ° C. | (1) ACD |
Koc | 26.0 | Ph 4; Temp: 25 ° C. | (1) ACD |
Koc | 51.0 | Ph 5; Temp: 25 ° C. | (1) ACD |
Koc | 56.4 | Ph 6; Temp: 25 ° C. | (1) ACD |
Koc | 57.0.0 | Ph 7; Temp: 25 ° C. | (1) ACD |
Koc | 57.1 | Ph 8; Temp: 25 ° C. | (1) ACD |
Koc | 57.1 | Ph 9; Temp: 25 ° C. | (1) ACD |
Koc | 57.0.0 | Ph 10; Temp: 25 ° C. | (1) ACD |
logd | -1.70 | Ph 1; Temp: 25 ° C. | (1) ACD |
logd | -1.25 | Ph 2; Temp: 25 ° C. | (1) ACD |
logd | -0.40 | Ph 3; Temp: 25 ° C. | (1) ACD |
logd | 0.36 | Ph 4; Temp: 25 ° C. | (1) ACD |
logd | 0.65 | Ph 5; Temp: 25 ° C. | (1) ACD |
logd | 0.69 | Ph 6; Temp: 25 ° C. | (1) ACD |
logd | 0.70 | Ph 7; Temp: 25 ° C. | (1) ACD |
logd | 0.70 | Ph 8; Temp: 25 ° C. | (1) ACD |
logd | 0.70 | Ph 9; Temp: 25 ° C. | (1) ACD |
logd | 0.70 | Ph 10; Temp: 25 ° C. | (1) ACD |
logp | 0.697 ± 0.596 | Temp: 25 ° C. | (1) ACD |
Misneachd solbalileachd neo-ghnèitheach mòr | 3.7 G / L | Temp: 25 ° C. | (1) ACD |
Solbuility mòr | 886 G / L | Ph 1; Temp: 25 ° C. | (1) ACD |
Solbuility mòr | 309 G / L | Ph 2; Temp: 25 ° C. | (1) ACD |
Solbuility mòr | 45 G / L | Ph 3; Temp: 25 ° C. | (1) ACD |
Solbuility mòr | 7.9 G / L | Ph 4; Temp: 25 ° C. | (1) ACD |
Solbuility mòr | 3.9 G / L | Ph 5; Temp: 25 ° C. | (1) ACD |
Solbuility mòr | 3.7 G / L | Ph 6; Temp: 25 ° C. | (1) ACD |
Solbuility mòr | 3.7 G / L | Ph 7; Temp: 25 ° C. | (1) ACD |
Seilbh | Luach | Suidheachadh | Stòr |
Solbuility mòr | 3.7 G / L | Ph 8; Temp: 25 ° C. | (1) ACD |
Solbuility mòr | 3.7 G / L | Ph 9; Temp: 25 ° C. | (1) ACD |
Solbuility mòr | 3.7 G / L | Ph 10; Temp: 25 ° C. | (1) ACD |
Solbuility mòr | 3.7 G / L | Uisge neo-ainmichte pH 8.07; Temp: 25 ° C. | (1) ACD |
Solbalileachd neo-ghnèitheach molar | 0.013 Mol / L. | Temp: 25 ° C. | (1) ACD |
Solubility molar | 3.15 Mol / l | Ph 1; Temp: 25 ° C. | (1) ACD |
Solubility molar | 1.10 Mol / l | Ph 2; Temp: 25 ° C. | (1) ACD |
Solubility molar | 0.16 Mol / L. | Ph 3; Temp: 25 ° C. | (1) ACD |
Solubility molar | 0.028 Mol / L. | Ph 4; Temp: 25 ° C. | (1) ACD |
Solubility molar | 0.014 mol / l | Ph 5; Temp: 25 ° C. | (1) ACD |
Solubility molar | 0.013 Mol / L. | Ph 6; Temp: 25 ° C. | (1) ACD |
Solubility molar | 0.013 Mol / L. | Ph 7; Temp: 25 ° C. | (1) ACD |
Solubility molar | 0.013 Mol / L. | Ph 8; Temp: 25 ° C. | (1) ACD |
Solubility molar | 0.013 Mol / L. | Ph 9; Temp: 25 ° C. | (1) ACD |
Solubility molar | 0.013 Mol / L. | Ph 10; Temp: 25 ° C. | (1) ACD |
Solubility molar | 0.013 Mol / L. | Uisge neo-ainmichte pH 8.07; Temp: 25 ° C. | (1) ACD |
Cuideam molecular | 281.27 | ||
paka | 13.13 ± 0.70 | Temp as searbhagach: 25 ° C. | (1) ACD |
paka | 3.82 ± 0.10 | Temp as bunaitiche: 25 ° C. | (1) ACD |
Cuideam vapor | 2.02 x 10-16 Torr | Temp: 25 ° C. | (1) ACD |
(1) Air a thomhas a 'cleachdadh leasachadh ceimigeachd adhartach (ACD / LABS) Bathar-bog V11.02 (© 1994-2023 ACD / LAìoban)
Seilbh | Luach | Suidheachadh | Stòr |
Dùmhlachd | 1.84 ± 0.1 G / cm3 | Temp: 20 ° C; Brùth: 760 Torr | (1) ACD |
Tomhas-lìonaidh molar | 152.5 ± 7.0 cm3 / mol | Temp: 20 ° C; Brùth: 760 Torr | (1) ACD |
(1) Air a thomhas a 'cleachdadh leasachadh ceimigeachd adhartach (ACD / LABS) Bathar-bog V11.02 (© 1994-2023 ACD / LAìoban)
Seilbh | Luach | Stòr cumhachd |
Bannan gu tur ro-bheathaichte | 5 | (1) ACD |
Hrrairean | 9 | (1) ACD |
Hnors her | 4 | (1) ACD |
Seilbh | Luach | Suidheachadh | Stòr |
H tabhartaiche / geurraiche suim | 13 | (1) ACD | |
logp | 0.697 ± 0.596 | Temp: 25 ° C. | (1) ACD |
Cuideam molecular | 281.27 |
(1) Air a thomhas a 'cleachdadh leasachadh ceimigeachd adhartach (ACD / LABS) Bathar-bog V11.02 (© 1994-2023 ACD / LAìoban)
Seilbh | Luach | Stòr cumhachd |
Raon uachdar pòla | 129 A2 | (1) ACD |
(1) Air a thomhas a 'cleachdadh leasachadh ceimigeachd adhartach (ACD / LABS) Bathar-bog V11.02 (© 1994-2023 ACD / LAìoban)
Seilbh | Luach | Suidheachadh | Stòr |
Point Point | 623.8 ± 65.0 ° C. | Brùth: 760 Torr | (1) ACD |
Enthalpy of Vaporization | 97.11 ± 3.0 kJ / mol | Brùth: 760 Torr | (1) ACD |
Puing Flash | 331.0 ± 34.3 ° C. | (1) ACD |
(1) Air a thomhas a 'cleachdadh leasachadh ceimigeachd adhartach (ACD / LABS) Bathar-bog V11.02 (© 1994-2023 ACD / LAìoban)
Spectra ri fhaighinn
1 h nmr
13 c nmr
Còd | Aithris cunnart | Stòr |
H303 | Faodaidh e a bhith cronail ma tha thu a 'slugadh | Eòlaiche air a ghlèidheadh |