C41H39No6 1-Peroxyphylx) PhenyLm Ethoxy] Methyl]-, (2s, 4r) - Aci, Aci, Aci, ACI)
Key Dalili | Daraja | Sharaɗi |
Nauyi na kwayoyin | 641.75 | - |
Tafasa matsayi (annabta) | 768.7 ± kashi 4.0 ° C | Latsa: 760 Torr |
Density (annabta) | 1.237 ± 0.06 g / cm3 | Hemp: 20 ° C; Latsa: 760 Torr |
Pka (annabta) | 14.50 ± 0.40 | Mafi yawan tempt: 25 ° C |
Canonical murmushi O = c (cc1c = 2c = CC4C = CC31 = CC4COC (CC5) CC4COC (CC5) CC4COC (CC5) CC4COC (CC5) CC4COC (CC5)
Murmushin Isomeric C (OC [C] 1n (C
Inci
Inchi = 1s / c41h39no6 / c1-45-5-5-5-5-5-18-3-5 (4,4-2-3-5 (43) (43) (31) (31) (4) (4) (3) (48) (31) (31) (31) (31) (31) (31) (31) (31) (31) (31) (31). 44) 47-27-39-3-8-8-8-35 (37) 36-13-7-7-7-7-7-7-7-7-7-7-7H2 / T31 / M0 / s1
Maɓallin Inchi
Qpxskgjqebdwes-ajqtzopssa-n
2 wasu sunaye na wannan abu
1-Peroxyelyl 1 - [4-metoxyphoxy] methyl] -4-hydroxy-4h-transetl ester, (Zci); 9h-cliorn-9-ylmethyl (2s, 4r) -2 - [BIs (4-metoxyphoxy
Kayan da ake samu |
Nazarin halitta |
Na kemistri |
Yawa |
Lipinski |
Tsarin ya shafi |
Rashin ƙarfi |
Nazarin halitta
Dukiya | Daraja | Sharaɗi | Mafari |
Bayani na Bioconcentoration | 1.00 x 106 | pH 1; HATHI: 25 ° C | (1) ACD |
Bayani na Bioconcentoration | 1.00 x 106 | PH 2; HATHI: 25 ° C | (1) ACD |
Bayani na Bioconcentoration | 1.00 x 106 | PH 3; HATHI: 25 ° C | (1) ACD |
Bayani na Bioconcentoration | 1.00 x 106 | pH 4; HATHI: 25 ° C | (1) ACD |
Bayani na Bioconcentoration | 1.00 x 106 | PH 5; HATHI: 25 ° C | (1) ACD |
Bayani na Bioconcentoration | 1.00 x 106 | pH 6; HATHI: 25 ° C | (1) ACD |
Bayani na Bioconcentoration | 1.00 x 106 | PH 7; HATHI: 25 ° C | (1) ACD |
Bayani na Bioconcentoration | 1.00 x 106 | PH 8; HATHI: 25 ° C | (1) ACD |
Bayani na Bioconcentoration | 1.00 x 106 | PH 9; HATHI: 25 ° C | (1) ACD |
Bayani na Bioconcentoration | 1.00 x 106 | PH 10; HATHI: 25 ° C | (1) ACD |
(1) Lissafi ta amfani da haɓaka keɓaɓɓe na Chemistry (ACD / LABS) Software V11.02 (© 1994-2023 ACD / Lags)
Na kemistri
Dukiya | Daraja | Sharaɗi | Mafari |
Koc | 7.70 x 105 | pH 1; HATHI: 25 ° C | (1) ACD |
Koc | 7.70 x 105 | PH 2; HATHI: 25 ° C | (1) ACD |
Koc | 7.70 x 105 | PH 3; HATHI: 25 ° C | (1) ACD |
Koc | 7.70 x 105 | pH 4; HATHI: 25 ° C | (1) ACD |
Koc | 7.70 x 105 | PH 5; HATHI: 25 ° C | (1) ACD |
Koc | 7.70 x 105 | pH 6; HATHI: 25 ° C | (1) ACD |
Koc | 7.70 x 105 | PH 7; HATHI: 25 ° C | (1) ACD |
Koc | 7.70 x 105 | PH 8; HATHI: 25 ° C | (1) ACD |
Koc | 7.70 x 105 | PH 9; HATHI: 25 ° C | (1) ACD |
Koc | 7.70 x 105 | PH 10; HATHI: 25 ° C | (1) ACD |
Dukiya | Daraja | Sharaɗi | Mafari |
yi biyayya | 8.29 | pH 1; HATHI: 25 ° C | (1) ACD |
yi biyayya | 8.29 | PH 2; HATHI: 25 ° C | (1) ACD |
yi biyayya | 8.29 | PH 3; HATHI: 25 ° C | (1) ACD |
yi biyayya | 8.29 | pH 4; HATHI: 25 ° C | (1) ACD |
yi biyayya | 8.29 | PH 5; HATHI: 25 ° C | (1) ACD |
yi biyayya | 8.29 | pH 6; HATHI: 25 ° C | (1) ACD |
yi biyayya | 8.29 | PH 7; HATHI: 25 ° C | (1) ACD |
yi biyayya | 8.29 | PH 8; HATHI: 25 ° C | (1) ACD |
yi biyayya | 8.29 | PH 9; HATHI: 25 ° C | (1) ACD |
yi biyayya | 8.29 | PH 10; HATHI: 25 ° C | (1) ACD |
logp | 8.289 ± 0.729 | HATHI: 25 ° C | (1) ACD |
Taro na kwantar da hankali | 4.7 x 10-6 g / l | HATHI: 25 ° C | (1) ACD |
Siyarwar taro | 4.7 x 10-6 g / l | pH 1; HATHI: 25 ° C | (1) ACD |
Siyarwar taro | 4.7 x 10-6 g / l | PH 2; HATHI: 25 ° C | (1) ACD |
Siyarwar taro | 4.7 x 10-6 g / l | PH 3; HATHI: 25 ° C | (1) ACD |
Siyarwar taro | 4.7 x 10-6 g / l | pH 4; HATHI: 25 ° C | (1) ACD |
Siyarwar taro | 4.7 x 10-6 g / l | PH 5; HATHI: 25 ° C | (1) ACD |
Siyarwar taro | 4.7 x 10-6 g / l | pH 6; HATHI: 25 ° C | (1) ACD |
Siyarwar taro | 4.7 x 10-6 g / l | PH 7; HATHI: 25 ° C | (1) ACD |
Siyarwar taro | 4.7 x 10-6 g / l | PH 8; HATHI: 25 ° C | (1) ACD |
Siyarwar taro | 4.7 x 10-6 g / l | PH 9; HATHI: 25 ° C | (1) ACD |
Siyarwar taro | 4.7 x 10-6 g / l | PH 10; HATHI: 25 ° C | (1) ACD |
Siyarwar taro | 4.7 x 10-6 g / l | Unbuled ruwa ph 7.00; HATHI: 25 ° C | (1) ACD |
Maganin Magana na Magana | 7.3 x 10-9 mol / l | HATHI: 25 ° C | (1) ACD |
Ƙirar Molar | 7.3 x 10-9 mol / l | pH 1; HATHI: 25 ° C | (1) ACD |
Ƙirar Molar | 7.3 x 10-9 mol / l | PH 2; HATHI: 25 ° C | (1) ACD |
Ƙirar Molar | 7.3 x 10-9 mol / l | PH 3; HATHI: 25 ° C | (1) ACD |
Ƙirar Molar | 7.3 x 10-9 mol / l | pH 4; HATHI: 25 ° C | (1) ACD |
Ƙirar Molar | 7.3 x 10-9 mol / l | PH 5; HATHI: 25 ° C | (1) ACD |
Ƙirar Molar | 7.3 x 10-9 mol / l | pH 6; HATHI: 25 ° C | (1) ACD |
Ƙirar Molar | 7.3 x 10-9 mol / l | PH 7; HATHI: 25 ° C | (1) ACD |
Ƙirar Molar | 7.3 x 10-9 mol / l | PH 8; HATHI: 25 ° C | (1) ACD |
Dukiya | Daraja | Sharaɗi | Mafari |
Ƙirar Molar | 7.3 x 10-9 mol / l | PH 9; HATHI: 25 ° C | (1) ACD |
Ƙirar Molar | 7.3 x 10-9 mol / l | PH 10; HATHI: 25 ° C | (1) ACD |
Ƙirar Molar | 7.3 x 10-9 mol / l | Unbuled ruwa ph 7.00; HATHI: 25 ° C | (1) ACD |
Nauyi na kwayoyin | 641.75 | ||
Pka | 14.50 ± 0.40 | Mafi yawan tempt: 25 ° C | (1) ACD |
Pka | -3.24 ± 0.60 | Mafi yawan Temp: 25 ° C | (1) ACD |
Vapor matsa lamba | 7.42 x 10-200 torr | HATHI: 25 ° C | (1) ACD |
(1) Lissafi ta amfani da haɓaka keɓaɓɓe na Chemistry (ACD / LABS) Software V11.02 (© 1994-2023 ACD / Lags)
Yawa
Dukiya | Daraja | Sharaɗi | Mafari |
Yawa | 1.237 ± 0.06 g / cm3 | Hemp: 20 ° C; Latsa: 760 Torr | (1) ACD |
Mai launi mai mor. | 518.4 ± 3.0 CM3 / MOL | Hemp: 20 ° C; Latsa: 760 Torr | (1) ACD |
(1) Lissafi ta amfani da haɓaka keɓaɓɓe na Chemistry (ACD / LABS) Software V11.02 (© 1994-2023 ACD / Lags)
Lipinski
Dukiya | Daraja | Sharaɗi | Mafari |
Kyaututtuka na Rotatatable | 12 | (1) ACD | |
H revors | 7 | (1) ACD | |
H Masu ba da gudummawa | 1 | (1) ACD | |
H Kyauta / Mai ba da Kyauta | 8 | (1) ACD | |
logp | 8.289 ± 0.729 | HATHI: 25 ° C | (1) ACD |
Nauyi na kwayoyin | 641.75 |
(1) Lissafi ta amfani da haɓaka keɓaɓɓe na Chemistry (ACD / LABS) Software V11.02 (© 1994-2023 ACD / Lags)
Tsarin ya shafi
Dukiya | Daraja | Sharaɗi | Mafari |
Yankin polar | 77.5 A2 | (1) ACD |
(1) Lissafi ta amfani da haɓaka keɓaɓɓe na Chemistry (ACD / LABS) Software V11.02 (© 1994-2023 ACD / Lags)
Rashin ƙarfi
Dukiya | Daraja | Sharaɗi | Mafari |
Tafasa | 768.7 ± kashi 4.0 ° C | Latsa: 760 Torr | (1) ACD |
Entalpy na Vaporization | 117.42 ± 3.0 KJ / MOL | Latsa: 760 Torr | (1) ACD |
M hanya | 418.7 ± 32.9 ° C | (1) ACD |
(1) Lissafi ta amfani da haɓaka keɓaɓɓe na Chemistry (ACD / LABS) Software V11.02 (© 1994-2023 ACD / Lags)
Spectra akwai
1H nmr
13C nmr