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C38H49NO7 1- Pyrrolidinedodecanoic acid, 2- [[bis (4-methoxyphenyl) phenylm ethoxy] methyl] -4-hydroxy-λ-oxo-, (2s, 4r)-(ACI)

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C38H49NO7 1- Pyrrolidinedodecanoic acid, 2- [[bis (4-methoxyphenyl) phenylm ethoxy] methyl] -4-hydroxy-λ-oxo-, (2s, 4r)-(ACI) ilionyesha picha
  • C38H49NO7 1- Pyrrolidinedodecanoic acid, 2- [[bis (4-methoxyphenyl) phenylm ethoxy] methyl] -4-hydroxy-λ-oxo-, (2s, 4r)-(ACI)

C38H49NO7 1- Pyrrolidinedodecanoic acid, 2- [[bis (4-methoxyphenyl) phenylm ethoxy] methyl] -4-hydroxy-λ-oxo-, (2s, 4r)-(ACI)

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Maelezo ya bidhaa

Vitambulisho vya bidhaa

Mali ya mwili

Sifa muhimu za mwili Thamani Hali
Uzito wa Masi 631.80 -
Kiwango cha kuchemsha (kilitabiriwa) 779.4 ± 60.0 ° C. Bonyeza: 760 Torr
Uzani (uliotabiriwa) 1.154 ± 0.06 g/cm3 Temp: 20 ° C; Bonyeza: 760 Torr
PKA (alitabiri) 4.78 ± 0.10 Templeti nyingi za asidi: 25 ° C.

Majina mengine na vitambulisho

Tabasamu za Canonical O = C (O) CCCCCCCCCCC (= O) N1CC (O) CC1COC (C = 2C = CC = CC2) (C3 = CC = C (OC) C = C3) C4 = CC = C (OC) C = C4
Isomeric Smiles C (OC [C@H] 1N (C (CCCCCCCCCC (O) = O) = O) C [C@H] (O) C1) (C2 = CC = C (OC) C = C2) (C3 = CC = C (OC) C = C3) C4 = CC = CC C4
Inchi
Inchi = 1S/C38H49NO7/C1-44-34-22-18-30 (19-23-34) 38 (29-14-10-9-11-15-29,31-20-24-35 (45-2) 25-21-31) 46-28-32-36 (45-2) 25-21-31) 46-28-32-32 (40) 36 (41) 16-12-7-5-3-4-6-8-13-17-37 (42) 43/H9-11,14-15,18-25,32-33,40h, 3-8,12-13,16-17,26-28h2,1-2h3, (h, 42,43
Ufunguo wa Inchi
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Mali zilizotabiriwa

Mali inapatikana
Kibaolojia
Kemikali
Wiani
Lipinski
Muundo unaohusiana
Mafuta

Kibaolojia

Mali Thamani Hali Chanzo
Sababu ya bioconcentration 2.46 x 105 pH 1; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 2.46 x 105 pH 2; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 2.42 x 105 pH 3; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 2.11 x 105 pH 4; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 92400 pH 5; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 14000 pH 6; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 1510 pH 7; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 192 pH 8; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 58.6 pH 9; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 45.3 pH 10; Temp: 25 ° c (1) ACD

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Kemikali

Mali Thamani Hali Chanzo
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
logi 7.40 pH 1; Temp: 25 ° c (1) ACD

 

Mali Thamani Hali Chanzo
logi 7.40 pH 2; Temp: 25 ° c (1) ACD
logi 7.39 pH 3; Temp: 25 ° c (1) ACD
logi 7.33 pH 4; Temp: 25 ° c (1) ACD
logi 6.97 pH 5; Temp: 25 ° c (1) ACD
logi 6.15 pH 6; Temp: 25 ° c (1) ACD
logi 5.19 pH 7; Temp: 25 ° c (1) ACD
logi 4.29 pH 8; Temp: 25 ° c (1) ACD
logi 3.77 pH 9; Temp: 25 ° c (1) ACD
logi 3.66 pH 10; Temp: 25 ° c (1) ACD
Logp 7.397 ± 0.598 Temp: 25 ° c (1) ACD
Umumunyifu wa ndani 1.3 x 10-4 g/l Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 1.3 x 10-4 g/l pH 1; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 1.3 x 10-4 g/l pH 2; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 1.3 x 10-4 g/l pH 3; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 1.5 x 10-4 g/l pH 4; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 3.5 x 10-4 g/l pH 5; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 2.3 x 10-3 g/l pH 6; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 0.021 g/l pH 7; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 0.17 g/l pH 8; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 0.55 g/l pH 9; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 0.69 g/l pH 10; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 1.3 x 10-3 g/l Maji yasiyokuwa na maji pH 5.73; Temp: 25 ° c (1) ACD
Umumunyifu wa ndani wa molar 2.1 x 10-7 mol/l Temp: 25 ° c (1) ACD
Umumunyifu wa molar 2.1 x 10-7 mol/l pH 1; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 2.1 x 10-7 mol/l pH 2; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 2.1 x 10-7 mol/l pH 3; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 2.4 x 10-7 mol/l pH 4; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 5.5 x 10-7 mol/l pH 5; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 3.6 x 10-6 mol/l pH 6; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 3.4 x 10-5 mol/l pH 7; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 2.7 x 10-4 mol/l pH 8; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 8.7 x 10-4 mol/l pH 9; Temp: 25 ° c (1) ACD

 

Mali Thamani Hali Chanzo
Umumunyifu wa molar 1.1 x 10-3 mol/l pH 10; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 2.1 x 10-6 mol/l Maji yasiyokuwa na maji pH 5.73; Temp: 25 ° c (1) ACD
Uzito wa Masi 631.80    
PKA 4.78 ± 0.10 Templeti nyingi za asidi: 25 ° C. (1) ACD
PKA -2.31 ± 0.60 Muda wa msingi zaidi: 25 ° C. (1) ACD
Shinikizo la mvuke 1.42 x 10-25 Torr Temp: 25 ° c (1) ACD

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Wiani

Mali Thamani Hali Chanzo
Wiani 1.154 ± 0.06 g/cm3 Temp: 20 ° C; Bonyeza: 760 Torr (1) ACD
Kiasi cha molar 547.3 ± 3.0 cm3/mol Temp: 20 ° C; Bonyeza: 760 Torr (1) ACD

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Lipinski

Mali Thamani Hali Chanzo
Vifungo vya mzunguko wa bure 20   (1) ACD
Wapokeaji 8   (1) ACD
H wafadhili 2   (1) ACD
H wafadhili/jumla ya jumla 10   (1) ACD
Logp 7.397 ± 0.598 Temp: 25 ° c (1) ACD
Uzito wa Masi 631.80    

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Muundo unaohusiana

Mali Thamani

Hali

 Chanzo
Eneo la uso wa polar 106 A2 (1) ACD

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Mafuta

Mali Thamani Hali Chanzo
Kiwango cha kuchemsha 779.4 ± 60.0 ° C. Bonyeza: 760 Torr (1) ACD
Enthalpy ya mvuke 118.97 ± 3.0 kJ/mol Bonyeza: 760 Torr (1) ACD
Kiwango cha Flash 425.2 ± 32.9 ° C.   (1) ACD

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Utabiri uliotabiriwa

Spectra inapatikana
1H NMR
13C NMR

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