C31h30n2o7 6h-furo [2 ', 3', 3 ': 4,5] Pirimidin-6 --2,3,3a, 9a-tetrarro-3-gidrokry-7- mediok - (2R, 3R, 3R, 9AR) - (9ci, Aci)

mahsulot

C31h30n2o7 6h-furo [2 ', 3', 3 ': 4,5] Pirimidin-6 --2,3,3a, 9a-tetrarro-3-gidrokry-7- mediok - (2R, 3R, 3R, 9AR) - (9ci, Aci)

Asosiy ma'lumotlar:


Mahsulot tafsilotlari

Mahsulot teglari

Jismoniy xususiyatlar

Asosiy jismoniy xususiyatlar Qiymati Shart
Molekulyar og'irlik 542.58 -
Qaynab turgan nuqta (bashorat qilingan) 692.9 ± 65,0 ° C Matbuot: 760 tor
Zichlik (bashorat qilingan) 1.33 ± 0 g / sm3 Temp: 20 ° C; Matbuot: 760 tor
PKA (bashorat qilingan) 12.51 ± 0,60 Aksariyat kislotali temp: 25 ° C

Boshqa ismlar va identifikatorlar

Canonik tabassum o = c1n = c2oc3c (OC3N2C = CC4) COC (C5 = CC = C1C) c6 = CC = C6 C = C6
Izemerik tabassumlar c (OC [C @@ @@ @@ @@ @@ cc = c (c) c4) (C4 = CC = C4) c6 = cc = c4 cc = c6
Kelini
InChI=1S/C31H30N2O7/c1-19-17-33-29-27(40-30(33)32-28(19)35)26(34)25(39-29)18-38-31(20-7-5-4-6-8-20,21-9-13-23(36-2)14-10-21
) 22-11-15-2-224 (37-22 / H4-17,25-57,24,34,34,34h, 18h2,1-3h3 / 2, 26-, 26- / s1
Inchi tugmachasi
BqeqceZnlikssh-citkvlssa-n
1 Ushbu modda uchun boshqa ism
(2R, 3R, 3A, 9AR) -2 - [Bis (4-metvophenil) fenilmetroxy] - 9.a-tetrapenil-3-gidroksy-6,5] Pirimidin-6-biri

Eksperimental spektr

Spektr mavjud
1H nmr
NMR nmr
Massa

Bashorat qilingan xususiyatlar

Xususiyatlar mavjud
Biologik
Kimyoviy
Zichlik
Litski
Tuzilishi bilan bog'liq
Issiqlik

Biologik

Mulk Qiymati Shart Manba
Bioconterstratsion omil 2800 PH 1; Temp: 25 ° C (1) ACD
Bioconterstratsion omil 2800 PH 2; Temp: 25 ° C (1) ACD
Bioconterstratsion omil 2800 pH 3; Temp: 25 ° C (1) ACD
Bioconterstratsion omil 2800 PH 4; Temp: 25 ° C (1) ACD
Bioconterstratsion omil 2800 PH 5; Temp: 25 ° C (1) ACD
Bioconterstratsion omil 2800 pH 6; Temp: 25 ° C (1) ACD
Bioconterstratsion omil 2800 PH 7; Temp: 25 ° C (1) ACD
Bioconterstratsion omil 2800 PH 8; Temp: 25 ° C (1) ACD
Bioconterstratsion omil 2800 PH 9; Temp: 25 ° C (1) ACD
Bioconterstratsion omil 2790 PH 10; Temp: 25 ° C (1) ACD

(1) Ilg'or kimyoviy rivojlanish (ACD / Labs) yordamida hisoblab chiqilgan V11.02 (© 1994-2023 ACD / Labs) yordamida hisoblab chiqilgan

Kimyoviy

Mulk Qiymati Shart Manba
Koc 10200 PH 1; Temp: 25 ° C (1) ACD
Koc 10200 PH 2; Temp: 25 ° C (1) ACD
Koc 10200 pH 3; Temp: 25 ° C (1) ACD
Koc 10200 PH 4; Temp: 25 ° C (1) ACD
Koc 10200 PH 5; Temp: 25 ° C (1) ACD

 

Mulk Qiymati Shart Manba
Koc 10200 pH 6; Temp: 25 ° C (1) ACD
Koc 10200 PH 7; Temp: 25 ° C (1) ACD
Koc 10200 PH 8; Temp: 25 ° C (1) ACD
Koc 10200 PH 9; Temp: 25 ° C (1) ACD
Koc 10200 PH 10; Temp: 25 ° C (1) ACD
logd 4.84 PH 1; Temp: 25 ° C (1) ACD
logd 4.84 PH 2; Temp: 25 ° C (1) ACD
logd 4.84 pH 3; Temp: 25 ° C (1) ACD
logd 4.84 PH 4; Temp: 25 ° C (1) ACD
logd 4.84 PH 5; Temp: 25 ° C (1) ACD
logd 4.84 pH 6; Temp: 25 ° C (1) ACD
logd 4.84 PH 7; Temp: 25 ° C (1) ACD
logd 4.84 PH 8; Temp: 25 ° C (1) ACD
logd 4.84 PH 9; Temp: 25 ° C (1) ACD
logd 4.84 PH 10; Temp: 25 ° C (1) ACD
logp 4.839 ± 0.618 Temp: 25 ° C (1) ACD
Ommaviy eriylik 3.6 X 10-4 g / l Temp: 25 ° C (1) ACD
Ommaviy eruvchanlik 3.6 X 10-4 g / l PH 1; Temp: 25 ° C (1) ACD
Ommaviy eruvchanlik 3.6 X 10-4 g / l PH 2; Temp: 25 ° C (1) ACD
Ommaviy eruvchanlik 3.6 X 10-4 g / l pH 3; Temp: 25 ° C (1) ACD
Ommaviy eruvchanlik 3.6 X 10-4 g / l PH 4; Temp: 25 ° C (1) ACD
Ommaviy eruvchanlik 3.6 X 10-4 g / l PH 5; Temp: 25 ° C (1) ACD
Ommaviy eruvchanlik 3.6 X 10-4 g / l pH 6; Temp: 25 ° C (1) ACD
Ommaviy eruvchanlik 3.6 X 10-4 g / l PH 7; Temp: 25 ° C (1) ACD
Ommaviy eruvchanlik 3.6 X 10-4 g / l PH 8; Temp: 25 ° C (1) ACD
Ommaviy eruvchanlik 3.6 X 10-4 g / l PH 9; Temp: 25 ° C (1) ACD
Ommaviy eruvchanlik 3.6 X 10-4 g / l PH 10; Temp: 25 ° C (1) ACD
Ommaviy eruvchanlik 3.6 X 10-4 g / l Neytral suv pH 7.00; Temp: 25 ° C (1) ACD
Molyar ichidagi eriylik 6.6 x 10-7 mol / l Temp: 25 ° C (1) ACD
Molyar eriylik 6.6 x 10-7 mol / l PH 1; Temp: 25 ° C (1) ACD
Molyar eriylik 6.6 x 10-7 mol / l PH 2; Temp: 25 ° C (1) ACD
Molyar eriylik 6.6 x 10-7 mol / l pH 3; Temp: 25 ° C (1) ACD

 

Mulk Qiymati Shart Manba
Molyar eriylik 6.6 x 10-7 mol / l PH 4; Temp: 25 ° C (1) ACD
Molyar eriylik 6.6 x 10-7 mol / l PH 5; Temp: 25 ° C (1) ACD
Molyar eriylik 6.6 x 10-7 mol / l pH 6; Temp: 25 ° C (1) ACD
Molyar eriylik 6.6 x 10-7 mol / l PH 7; Temp: 25 ° C (1) ACD
Molyar eriylik 6.6 x 10-7 mol / l PH 8; Temp: 25 ° C (1) ACD
Molyar eriylik 6.6 x 10-7 mol / l PH 9; Temp: 25 ° C (1) ACD
Molyar eriylik 6.7 x 10-7 mol / l PH 10; Temp: 25 ° C (1) ACD
Molyar eriylik 6.6 x 10-7 mol / l Neytral suv pH 7.00; Temp: 25 ° C (1) ACD
Molekulyar og'irlik 542.58    
pka 12.51 ± 0,60 Aksariyat kislotali temp: 25 ° C (1) ACD
pka -4.38 ± 0,60 Eng asosiy temp: 25 ° C (1) ACD
Bug 'bosimi 3.73 x 10-20 tor Temp: 25 ° C (1) ACD

(1) Ilg'or kimyoviy rivojlanish (ACD / Labs) yordamida hisoblab chiqilgan V11.02 (© 1994-2023 ACD / Labs) yordamida hisoblab chiqilgan

Zichlik

Mulk Qiymati Shart Manba
Zichlik 1.33 ± 0 g / sm3 Temp: 20 ° C; Matbuot: 760 tor (1) ACD
Molyar hajmi 404.9 ± 7.0 sm3 / mol Temp: 20 ° C; Matbuot: 760 tor (1) ACD

(1) Ilg'or kimyoviy rivojlanish (ACD / Labs) yordamida hisoblab chiqilgan V11.02 (© 1994-2023 ACD / Labs) yordamida hisoblab chiqilgan

Litski

Mulk Qiymati Shart Manba
Erkin aylanadigan aloqalar 9   (1) ACD
H maqolalari 9   (1) ACD
H donorlar 1   (1) ACD
H donor / qabul summasi 10   (1) ACD
logp 4.839 ± 0.618 Temp: 25 ° C (1) ACD
Molekulyar og'irlik 542.58    

(1) Ilg'or kimyoviy rivojlanish (ACD / Labs) yordamida hisoblab chiqilgan V11.02 (© 1994-2023 ACD / Labs) yordamida hisoblab chiqilgan

Tuzilishi bilan bog'liq

Mulk Qiymati

Shart

Manba
Polar sirt maydoni 99.1 A2 (1) ACD

(1) Ilg'or kimyoviy rivojlanish (ACD / Labs) yordamida hisoblab chiqilgan V11.02 (© 1994-2023 ACD / Labs) yordamida hisoblab chiqilgan

Issiqlik

Mulk Qiymati Shart Manba
Qaynab turgan nuqta 692.9 ± 65,0 ° C Matbuot: 760 tor (1) ACD
Bug'lanishning boshi 106.61 ± 3.0 kj / mol Matbuot: 760 tor (1) ACD
O't olish nuqtasi 372,8 ± 34,3 ° C   (1) ACD

(1) Ilg'or kimyoviy rivojlanish (ACD / Labs) yordamida hisoblab chiqilgan V11.02 (© 1994-2023 ACD / Labs) yordamida hisoblab chiqilgan

Bashorat qilingan spektr

Spektr mavjud
1H nmr
NMR nmr


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