C20H31NO5 Hepanoic acid, 3- methyl-5-methylmeth-4 -
Key Dalili | Daraja | Sharaɗi |
Nauyi na kwayoyin | 365.46 | - |
Tafasa matsayi (annabta) | 504.1 AKE 50.0 ° C | Latsa: 760 Torr |
Density (annabta) | 1.091 ± 0.06 g / cm3 | Hemp: 20 ° C; Latsa: 760 Torr |
Pka (annabta) | 11.82 ± 0.46 | Mafi yawan tempt: 25 ° C |
Canonical murmushi O = c (CC = 1c = CC1 = CC1) NC (C (O) OC (C) OC (C) OC (C) CC (C) CC
IMomeric murmushi [C @@ h] (Cc (cc (cc (cc (cc (cc (cc = cc = cc = cc = cc = cc = cc = cc =
Inci
Inchi = 1s / c20h31no5 / c1-6-15 (2) (24) (24) (24) (24) (24)) 21-15 H3, (H, 21,24) / t14-, 16 +, 18- / m0 / s1
Maɓallin Inchi
Aztsbawjolriruq-LECRRDOSA-N
Kayan da ake samu |
Nazarin halitta |
Na kemistri |
Yawa |
Lipinski |
Tsarin ya shafi |
Rashin ƙarfi |
Nazarin halitta
Dukiya | Daraja | Sharaɗi | Mafari |
Bayani na Bioconcentoration | 616 | pH 1; HATHI: 25 ° C | (1) ACD |
Bayani na Bioconcentoration | 617 | PH 2; HATHI: 25 ° C | (1) ACD |
Bayani na Bioconcentoration | 617 | PH 3; HATHI: 25 ° C | (1) ACD |
Bayani na Bioconcentoration | 617 | pH 4; HATHI: 25 ° C | (1) ACD |
Bayani na Bioconcentoration | 617 | PH 5; HATHI: 25 ° C | (1) ACD |
Bayani na Bioconcentoration | 617 | pH 6; HATHI: 25 ° C | (1) ACD |
Bayani na Bioconcentoration | 617 | PH 7; HATHI: 25 ° C | (1) ACD |
Bayani na Bioconcentoration | 617 | PH 8; HATHI: 25 ° C | (1) ACD |
Bayani na Bioconcentoration | 616 | PH 9; HATHI: 25 ° C | (1) ACD |
Bayani na Bioconcentoration | 604 | 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 | 3450 | pH 1; HATHI: 25 ° C | (1) ACD |
Koc | 3460 | PH 2; HATHI: 25 ° C | (1) ACD |
Koc | 3460 | PH 3; HATHI: 25 ° C | (1) ACD |
Koc | 3460 | pH 4; HATHI: 25 ° C | (1) ACD |
Koc | 3460 | PH 5; HATHI: 25 ° C | (1) ACD |
Koc | 3460 | pH 6; HATHI: 25 ° C | (1) ACD |
Koc | 3460 | PH 7; HATHI: 25 ° C | (1) ACD |
Koc | 3460 | PH 8; HATHI: 25 ° C | (1) ACD |
Koc | 3450 | PH 9; HATHI: 25 ° C | (1) ACD |
Koc | 3390 | PH 10; HATHI: 25 ° C | (1) ACD |
yi biyayya | 3.97 | pH 1; HATHI: 25 ° C | (1) ACD |
Dukiya | Daraja | Sharaɗi | Mafari |
yi biyayya | 3.97 | PH 2; HATHI: 25 ° C | (1) ACD |
yi biyayya | 3.97 | PH 3; HATHI: 25 ° C | (1) ACD |
yi biyayya | 3.97 | pH 4; HATHI: 25 ° C | (1) ACD |
yi biyayya | 3.97 | PH 5; HATHI: 25 ° C | (1) ACD |
yi biyayya | 3.97 | pH 6; HATHI: 25 ° C | (1) ACD |
yi biyayya | 3.97 | PH 7; HATHI: 25 ° C | (1) ACD |
yi biyayya | 3.97 | PH 8; HATHI: 25 ° C | (1) ACD |
yi biyayya | 3.97 | PH 9; HATHI: 25 ° C | (1) ACD |
yi biyayya | 3.96 | PH 10; HATHI: 25 ° C | (1) ACD |
logp | 3.974 ± 0.543 | HATHI: 25 ° C | (1) ACD |
Taro na kwantar da hankali | 0.062 g / l | HATHI: 25 ° C | (1) ACD |
Siyarwar taro | 0.062 g / l | pH 1; HATHI: 25 ° C | (1) ACD |
Siyarwar taro | 0.062 g / l | PH 2; HATHI: 25 ° C | (1) ACD |
Siyarwar taro | 0.062 g / l | PH 3; HATHI: 25 ° C | (1) ACD |
Siyarwar taro | 0.062 g / l | pH 4; HATHI: 25 ° C | (1) ACD |
Siyarwar taro | 0.062 g / l | PH 5; HATHI: 25 ° C | (1) ACD |
Siyarwar taro | 0.062 g / l | pH 6; HATHI: 25 ° C | (1) ACD |
Siyarwar taro | 0.062 g / l | PH 7; HATHI: 25 ° C | (1) ACD |
Siyarwar taro | 0.062 g / l | PH 8; HATHI: 25 ° C | (1) ACD |
Siyarwar taro | 0.062 g / l | PH 9; HATHI: 25 ° C | (1) ACD |
Siyarwar taro | 0.062 g / l | PH 10; HATHI: 25 ° C | (1) ACD |
Siyarwar taro | 0.062 g / l | Unbuled ruwa ph 6.49; HATHI: 25 ° C | (1) ACD |
Maganin Magana na Magana | 1.7 x 10-4 MOL / L | HATHI: 25 ° C | (1) ACD |
Ƙirar Molar | 1.7 x 10-4 MOL / L | pH 1; HATHI: 25 ° C | (1) ACD |
Ƙirar Molar | 1.7 x 10-4 MOL / L | PH 2; HATHI: 25 ° C | (1) ACD |
Ƙirar Molar | 1.7 x 10-4 MOL / L | PH 3; HATHI: 25 ° C | (1) ACD |
Ƙirar Molar | 1.7 x 10-4 MOL / L | pH 4; HATHI: 25 ° C | (1) ACD |
Ƙirar Molar | 1.7 x 10-4 MOL / L | PH 5; HATHI: 25 ° C | (1) ACD |
Ƙirar Molar | 1.7 x 10-4 MOL / L | pH 6; HATHI: 25 ° C | (1) ACD |
Ƙirar Molar | 1.7 x 10-4 MOL / L | PH 7; HATHI: 25 ° C | (1) ACD |
Ƙirar Molar | 1.7 x 10-4 MOL / L | PH 8; HATHI: 25 ° C | (1) ACD |
Ƙirar Molar | 1.7 x 10-4 MOL / L | PH 9; HATHI: 25 ° C | (1) ACD |
Dukiya | Daraja | Sharaɗi | Mafari |
Ƙirar Molar | 1.7 x 10-4 MOL / L | PH 10; HATHI: 25 ° C | (1) ACD |
Ƙirar Molar | 1.7 x 10-4 MOL / L | Unbuled ruwa ph 6.49; HATHI: 25 ° C | (1) ACD |
Nauyi na kwayoyin | 365.46 | ||
Pka | 11.82 ± 0.46 | Mafi yawan tempt: 25 ° C | (1) ACD |
Pka | -1.56 ± 0.70 | Mafi yawan Temp: 25 ° C | (1) ACD |
Vapor matsa lamba | 5.56 x 10-11 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 | 1.091 ± 0.06 g / cm3 | Hemp: 20 ° C; Latsa: 760 Torr | (1) ACD |
Mai launi mai mor. | 334.7 ± 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 | 6 | (1) ACD | |
H Masu ba da gudummawa | 2 | (1) ACD | |
H Kyauta / Mai ba da Kyauta | 8 | (1) ACD | |
logp | 3.974 ± 0.543 | HATHI: 25 ° C | (1) ACD |
Nauyi na kwayoyin | 365.46 |
(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 | 84.9 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 | 504.1 AKE 50.0 ° C | Latsa: 760 Torr | (1) ACD |
Entalpy na Vaporization | 81.44 ± 3.0 KJ / MOL | Latsa: 760 Torr | (1) ACD |
M hanya | 258.6 ± 30.1 ° 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
Tsari | Bayanin Hazard | Mafari |
H301 | Mai guba idan an haɗiye shi | Hukumar Kimiyya ta Turai (ECHA) rarrabuwa & kayan kwalliya - sanarwar rarrabuwa - kayan kwalliya na Turai - sanarwar rarrabuwa - sanarwar sanarwa |