C38h4h49No7 1- PyrrolidodeDanoic Acide, 2- [Bis (4-Uburyo bwa Athoxyle) -4-Hydroxy-λ-Oxo-) - (ACI)
Imbaraga z'umubiri | Agaciro | Imiterere |
Uburemere bwa molekile | 631.80 | - |
Ingingo itetse (Yahanuwe) | 779.4 ± 60.0 ° C. | Kanda: 760 Torr |
Ubucucike (bwahanuwe) | 1.154 ± 0.06 g / cm3 | Temp: 20 ° C; Kanda: 760 Torr |
PKA (byahanuwe) | 4.78 ± 0.10 | Acide menshi: 25 ° C. |
Canonical amwenyura o = c (o) ccccccccc (= o) n1cc (o) (cc = cc = cc = cc = cc = cc (oc) c = C4
Isomeric amwenyura c (oc [c @ h
Inchi
Inchi = 1s / c38h49No7 / C1-44-34-22-18-30 (19-23-34) 38 (29-14-19-9,3-31,3-31) 25-28-32-26-33 (32) 36 (41) 16-12-7-4-4-6-8-13-17-37 (42) 43 / H9-15,16,26,16,26-Y)
Inchi
Ceyltmdxadtbel-jhousyjsa-n
1 irindi zina ryibi bintu
(2s
Ibyiza birahari |
Ibinyabuzima |
Imiti |
Ubucucike |
Lipinski |
Imiterere |
Ubushyuhe |
Ibinyabuzima
Umutungo | Agaciro | Imiterere | Isoko |
BioConcentration | 2.46 x 105 | ph 1; Temp: 25 ° C. | (1) acd |
BioConcentration | 2.46 x 105 | ph 2; Temp: 25 ° C. | (1) acd |
BioConcentration | 2.42 X 105 | ph 3; Temp: 25 ° C. | (1) acd |
BioConcentration | 2.11 x 105 | ph 4; Temp: 25 ° C. | (1) acd |
BioConcentration | 92400 | ph 5; Temp: 25 ° C. | (1) acd |
BioConcentration | 14000 | pH 6; Temp: 25 ° C. | (1) acd |
BioConcentration | 1510 | pH 7; Temp: 25 ° C. | (1) acd |
BioConcentration | 192 | ph 8; Temp: 25 ° C. | (1) acd |
BioConcentration | 58.6 | pH 9; Temp: 25 ° C. | (1) acd |
BioConcentration | 45.3 | PH 10; Temp: 25 ° C. | (1) acd |
(1) kubarwa ukoresheje iterambere rya chimie ihamye (acd / laboratwari) software v11.02 (© 1994-2023 acd
Imiti
Umutungo | Agaciro | Imiterere | Isoko |
Koc | 2.52 x 105 | ph 1; Temp: 25 ° C. | (1) acd |
Koc | 2.51 x 105 | ph 2; Temp: 25 ° C. | (1) acd |
Koc | 2.47 x 105 | ph 3; Temp: 25 ° C. | (1) acd |
Koc | 2.16 x 105 | ph 4; Temp: 25 ° C. | (1) acd |
Koc | 94500 | ph 5; Temp: 25 ° C. | (1) acd |
Koc | 14300 | pH 6; Temp: 25 ° C. | (1) acd |
Koc | 1550 | pH 7; Temp: 25 ° C. | (1) acd |
Koc | 196 | ph 8; Temp: 25 ° C. | (1) acd |
Koc | 59.9 | pH 9; Temp: 25 ° C. | (1) acd |
Koc | 46.3 | PH 10; Temp: 25 ° C. | (1) acd |
Logd | 7.40 | ph 1; Temp: 25 ° C. | (1) acd |
Umutungo | Agaciro | Imiterere | Isoko |
Logd | 7.40 | ph 2; Temp: 25 ° C. | (1) acd |
Logd | 7.39 | ph 3; Temp: 25 ° C. | (1) acd |
Logd | 7.33 | ph 4; Temp: 25 ° C. | (1) acd |
Logd | 6.97 | ph 5; Temp: 25 ° C. | (1) acd |
Logd | 6.15 | pH 6; Temp: 25 ° C. | (1) acd |
Logd | 5.19 | pH 7; Temp: 25 ° C. | (1) acd |
Logd | 4.29 | ph 8; Temp: 25 ° C. | (1) acd |
Logd | 3.77 | pH 9; Temp: 25 ° C. | (1) acd |
Logd | 3.66 | PH 10; Temp: 25 ° C. | (1) acd |
LogP | 7.397 ± 0.598 | Temp: 25 ° C. | (1) acd |
Misa yimbere | 1.3 x 10-4 g / l | Temp: 25 ° C. | (1) acd |
Rusange | 1.3 x 10-4 g / l | ph 1; Temp: 25 ° C. | (1) acd |
Rusange | 1.3 x 10-4 g / l | ph 2; Temp: 25 ° C. | (1) acd |
Rusange | 1.3 x 10-4 g / l | ph 3; Temp: 25 ° C. | (1) acd |
Rusange | 1.5 x 10-4 g / l | ph 4; Temp: 25 ° C. | (1) acd |
Rusange | 3.5 x 10-4 g / l | ph 5; Temp: 25 ° C. | (1) acd |
Rusange | 2.3 x 10-3 G / L. | pH 6; Temp: 25 ° C. | (1) acd |
Rusange | 0.021 G / L. | pH 7; Temp: 25 ° C. | (1) acd |
Rusange | 0.17 g / l | ph 8; Temp: 25 ° C. | (1) acd |
Rusange | 0.55 g / l | pH 9; Temp: 25 ° C. | (1) acd |
Rusange | 0.69 g / l | PH 10; Temp: 25 ° C. | (1) acd |
Rusange | 1.3 x 10-3 G / L. | Amazi adahanitse PH 5.73; Temp: 25 ° C. | (1) acd |
Morlar Mainsic Lowelity | 2.1 x 10-7 mol / l | Temp: 25 ° C. | (1) acd |
Umuryango wawe | 2.1 x 10-7 mol / l | ph 1; Temp: 25 ° C. | (1) acd |
Umuryango wawe | 2.1 x 10-7 mol / l | ph 2; Temp: 25 ° C. | (1) acd |
Umuryango wawe | 2.1 x 10-7 mol / l | ph 3; Temp: 25 ° C. | (1) acd |
Umuryango wawe | 2.4 x 10-7 mol / l | ph 4; Temp: 25 ° C. | (1) acd |
Umuryango wawe | 5.5 x 10-7 mol / l | ph 5; Temp: 25 ° C. | (1) acd |
Umuryango wawe | 3.6 x 10-6 mol / l | pH 6; Temp: 25 ° C. | (1) acd |
Umuryango wawe | 3.4 x 10-5 Mol / l | pH 7; Temp: 25 ° C. | (1) acd |
Umuryango wawe | 2.7 x 10-4 Mol / l | ph 8; Temp: 25 ° C. | (1) acd |
Umuryango wawe | 8.7 x 10-4 Mol / l | pH 9; Temp: 25 ° C. | (1) acd |
Umutungo | Agaciro | Imiterere | Isoko |
Umuryango wawe | 1.1 x 10-3 mol / l | PH 10; Temp: 25 ° C. | (1) acd |
Umuryango wawe | 2.1 x 10-6 Mol / l | Amazi adahanitse PH 5.73; Temp: 25 ° C. | (1) acd |
Uburemere bwa molekile | 631.80 | ||
PKA | 4.78 ± 0.10 | Acide menshi: 25 ° C. | (1) acd |
PKA | -2.31 ± 0.60 | Icyiciro cyibanze: 25 ° C. | (1) acd |
Umuvuduko ukabije | 1.42 x 10-25 Torr | Temp: 25 ° C. | (1) acd |
(1) kubarwa ukoresheje iterambere rya chimie ihamye (acd / laboratwari) software v11.02 (© 1994-2023 acd
Ubucucike
Umutungo | Agaciro | Imiterere | Isoko |
Ubucucike | 1.154 ± 0.06 g / cm3 | Temp: 20 ° C; Kanda: 760 Torr | (1) acd |
Umubumbe | 547.3 ± 3.0 cm3 / mol | Temp: 20 ° C; Kanda: 760 Torr | (1) acd |
(1) kubarwa ukoresheje iterambere rya chimie ihamye (acd / laboratwari) software v11.02 (© 1994-2023 acd
Lipinski
Umutungo | Agaciro | Imiterere | Isoko |
Ubusambanyi bwuzuye | 20 | (1) acd | |
H yemera | 8 | (1) acd | |
H | 2 | (1) acd | |
H umuterankunga / kubyemera | 10 | (1) acd | |
LogP | 7.397 ± 0.598 | Temp: 25 ° C. | (1) acd |
Uburemere bwa molekile | 631.80 |
(1) kubarwa ukoresheje iterambere rya chimie ihamye (acd / laboratwari) software v11.02 (© 1994-2023 acd
Imiterere
Umutungo | Agaciro | Imiterere | Isoko |
Agace k'amashanyarazi | 106 A2 | (1) acd |
(1) kubarwa ukoresheje iterambere rya chimie ihamye (acd / laboratwari) software v11.02 (© 1994-2023 acd
Ubushyuhe
Umutungo | Agaciro | Imiterere | Isoko |
Ingingo itetse | 779.4 ± 60.0 ° C. | Kanda: 760 Torr | (1) acd |
Enthalp ya Vaporisation | 118.97 ± 3.0 kj / mol | Kanda: 760 Torr | (1) acd |
Flash point | 425.2 ± 32.9 ° C. | (1) acd |
(1) kubarwa ukoresheje iterambere rya chimie ihamye (acd / laboratwari) software v11.02 (© 1994-2023 acd
Spectra irahari
1h nmr
13c nmr