C31H32N2O8 mkojo, 5'-o- [bis (4-methoxyphenyl) phenylmethyl] -2'-o-methyl- (9c I, ACI)

Bidhaa

C31H32N2O8 mkojo, 5'-o- [bis (4-methoxyphenyl) phenylmethyl] -2'-o-methyl- (9c I, ACI)

Habari ya kimsingi:


Maelezo ya bidhaa

Vitambulisho vya bidhaa

Mali ya mwili

Sifa muhimu za mwili Thamani Hali
Uzito wa Masi 560.60 -
Uzani (uliotabiriwa) 1.35 ± 0.1 g/cm3 Temp: 20 ° C; Bonyeza: 760 Torr
PKA (alitabiri) 9.39 ± 0.10 Templeti nyingi za asidi: 25 ° C.

Majina mengine na vitambulisho

Tabasamu za Canonical O = C1c = Cn (C (= O) N1) C2OC (COC (C = 3C = CC = CC3) (C4 = CC = C (OC) C = C4) C5 = CC = C (OC) C = C5) C (O) C2OC
Isomeric Smiles C (OC [C@H] 1O [C@H] ([C@H] (OC) [C @@ H] 1O) N2C (= O) NC (= O) C = C2) (C3 = CC = C (OC) C = C3) (C4 = CC = C (OC) C = C4) C5 = CC = CC = CC = C5 = C5 = C5 = C5 = C5 = C5 = C5 = C5 = C5 = C5 = C5 = C5 = C5 = C5 = C5 = C5 = C5 = C5 = C5 = C5 = C5 = C5 = C5 = C5 = C5 = C5 = C = C5 = C5 = C5 = C = C5 = C = C5 = C = C5 = C5 = C = C5 = C = C5 = C = C5 = C = C5 = C = C5 = C = C5 = C = C = C5 = C = C5 = C =
Inchi
Inchi = 1S/C31H32N2O8/C1-37-23-13-9-21 (10-14-23) 31 (20-7-5-4-6-8-20,22-11-15-24 (38-2) 16-12-22) 40-19-25-27 (35) (39-3)
33-18-17-26 (34) 32-30 (33) 36/H4-18,25,27-29,35h, 19h2,1-3h3, (h, 32,34,36)/t25-, 27-, 28-, 29-/m1/s1
Ufunguo wa Inchi
Mfdhavfjdsrpkc-yxinzvnlsa-n
Majina mengine 2 kwa dutu hii
5'-O- [BIS (4-methoxyphenyl) phenylmethyl] -2'-O-methyluridine (ACI); 5'-O- (4,4'-dimethoxytrityl) -2'-O-methyluridine

Majaribio ya majaribio

Spectra inapatikana
1H NMR
Misa

Mali zilizotabiriwa

Mali inapatikana
Kibaolojia
Kemikali
Wiani
Lipinski
Muundo unaohusiana

Kibaolojia

Mali Thamani Hali Chanzo
Sababu ya bioconcentration 1240 pH 1; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 1240 pH 2; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 1240 pH 3; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 1240 pH 4; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 1240 pH 5; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 1240 pH 6; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 1230 pH 7; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 1190 pH 8; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 861 pH 9; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 238 pH 10; Temp: 25 ° c (1) ACD

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Kemikali

Mali Thamani Hali Chanzo
KOC 5690 pH 1; Temp: 25 ° c (1) ACD
KOC 5690 pH 2; Temp: 25 ° c (1) ACD
KOC 5690 pH 3; Temp: 25 ° c (1) ACD
KOC 5690 pH 4; Temp: 25 ° c (1) ACD
KOC 5690 pH 5; Temp: 25 ° c (1) ACD
KOC 5690 pH 6; Temp: 25 ° c (1) ACD
KOC 5670 pH 7; Temp: 25 ° c (1) ACD
KOC 5450 pH 8; Temp: 25 ° c (1) ACD

 

Mali Thamani Hali Chanzo
KOC 3960 pH 9; Temp: 25 ° c (1) ACD
KOC 1100 pH 10; Temp: 25 ° c (1) ACD
logi 4.37 pH 1; Temp: 25 ° c (1) ACD
logi 4.37 pH 2; Temp: 25 ° c (1) ACD
logi 4.37 pH 3; Temp: 25 ° c (1) ACD
logi 4.37 pH 4; Temp: 25 ° c (1) ACD
logi 4.37 pH 5; Temp: 25 ° c (1) ACD
logi 4.37 pH 6; Temp: 25 ° c (1) ACD
logi 4.37 pH 7; Temp: 25 ° c (1) ACD
logi 4.35 pH 8; Temp: 25 ° c (1) ACD
logi 4.21 pH 9; Temp: 25 ° c (1) ACD
logi 3.66 pH 10; Temp: 25 ° c (1) ACD
Logp 4.372 ± 0.582 Temp: 25 ° c (1) ACD
Umumunyifu wa ndani 3.7 x 10-4 g/l Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 3.7 x 10-4 g/l pH 1; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 3.7 x 10-4 g/l pH 2; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 3.7 x 10-4 g/l pH 3; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 3.7 x 10-4 g/l pH 4; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 3.7 x 10-4 g/l pH 5; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 3.7 x 10-4 g/l pH 6; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 3.7 x 10-4 g/l pH 7; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 3.8 x 10-4 g/l pH 8; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 5.3 x 10-4 g/l pH 9; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 1.9 x 10-3 g/l pH 10; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 3.7 x 10-4 g/l Maji yasiyokuwa na maji pH 6.99; Temp: 25 ° c (1) ACD
Umumunyifu wa ndani wa molar 6.6 x 10-7 mol/l Temp: 25 ° c (1) ACD
Umumunyifu wa molar 6.6 x 10-7 mol/l pH 1; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 6.6 x 10-7 mol/l pH 2; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 6.6 x 10-7 mol/l pH 3; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 6.6 x 10-7 mol/l pH 4; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 6.6 x 10-7 mol/l pH 5; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 6.6 x 10-7 mol/l pH 6; Temp: 25 ° c (1) ACD

 

Mali Thamani Hali Chanzo
Umumunyifu wa molar 6.6 x 10-7 mol/l pH 7; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 6.8 x 10-7 mol/l pH 8; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 9.4 x 10-7 mol/l pH 9; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 3.4 x 10-6 mol/l pH 10; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 6.6 x 10-7 mol/l Maji yasiyokuwa na maji pH 6.99; Temp: 25 ° c (1) ACD
Uzito wa Masi 560.60    
PKA 9.39 ± 0.10 Templeti nyingi za asidi: 25 ° C. (1) ACD

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Wiani

Mali Thamani Hali Chanzo
Wiani 1.35 ± 0.1 g/cm3 Temp: 20 ° C; Bonyeza: 760 Torr (1) ACD
Kiasi cha molar 412.9 ± 5.0 cm3/mol Temp: 20 ° C; Bonyeza: 760 Torr (1) ACD

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Lipinski

Mali Thamani Hali Chanzo
Vifungo vya mzunguko wa bure 11   (1) ACD
Wapokeaji 10   (1) ACD
H wafadhili 2   (1) ACD
H wafadhili/jumla ya jumla 12   (1) ACD
Logp 4.372 ± 0.582 Temp: 25 ° c (1) ACD
Uzito wa Masi 560.60    

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Muundo unaohusiana

Mali Thamani

Hali

Chanzo
Eneo la uso wa polar 116 A2 (1) ACD

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Utabiri uliotabiriwa

Spectra inapatikana
1H NMR
13C NMR


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