C38H49nnon7 1-PirimpiddeddOndyCoik kislotasy, 2- [bis (4-Medlfoxy-oveskili -4-gidroksy-λlemçe--olxy-λolkiýa---- - (aci) - (aci)
Esasy fiziki aýratynlyklary | Bahasy | Ýagdaýy |
Molekulýar agramy | 631.80 | - |
Gaýnadylan nokady (çak edilýär) | 779,4 ± 60.0 ° C. | MEKDEB: 760 torr |
Dykyzlygy (çak edilýär) | 1.154 ± 0.06 g / cm3 | Bu bellik: 20 ° C; MEKDEB: 760 torr |
pka (çak edilýär) | 4.78 ± 0.10 | "Kisidik temp: 25 ° C. |
Kanoniki ýylgyryşlar o = c (o) c (O) ccccockcc (O) cc1co (c = c = cc = cc = cc = cc = cc = c f = cc = c (c = cc = c) c f = c = c4
ISMARIGI ýylgyrýan c (OC [h] 1N (C @C) (C @) (C @ = CC = CC = C (C @) C [C @ = CC = CC = CC = CC = CC = CC.
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)46-28-32-26-33(40)27-39(32) 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)/t32-,33+/m0/s1
Inchi açary
EeeltmdxadBel-Johousizsjsa-n
Bu madda üçin başga bir at
(2s, 4r) -2 - [[bis (4 metsoxishenil) methliminf
Elýeterli häsiýetler |
Biologiki |
Himiki |
Dykyzlygy |
Lipinski |
Gurluşy |
Termylal |
Biologiki
Emläk | Bahasy | Ýagdaýy | Çeşme |
Bionokententrasiýa faktory | 2.46 x 105 | galasy; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 2.46 x 105 | galmak 2; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 2.42 x 105 | ph 3; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 2.11 x 105 | ph 4; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 92400 | ph 5; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 14000 | ph 6; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 1510 | ph 7; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 192 | ph 8; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 58.6 | ph 9; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 45.3 | ph 10; Memes: 25 ° C. | (1) ACD |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Himiki
Emläk | Bahasy | Ýagdaýy | Çeşme |
KOK | 2.52 x 105 | galasy; Memes: 25 ° C. | (1) ACD |
KOK | 2.51 x 105 | galmak 2; Memes: 25 ° C. | (1) ACD |
KOK | 2.47 x 105 | ph 3; Memes: 25 ° C. | (1) ACD |
KOK | 2.16 x 105 | ph 4; Memes: 25 ° C. | (1) ACD |
KOK | 94500 | ph 5; Memes: 25 ° C. | (1) ACD |
KOK | 14300 | ph 6; Memes: 25 ° C. | (1) ACD |
KOK | 1550 | ph 7; Memes: 25 ° C. | (1) ACD |
KOK | 196 | ph 8; Memes: 25 ° C. | (1) ACD |
KOK | 59.9 | ph 9; Memes: 25 ° C. | (1) ACD |
KOK | 46.3 | ph 10; Memes: 25 ° C. | (1) ACD |
surnal | 7.40 | galasy; Memes: 25 ° C. | (1) ACD |
Emläk | Bahasy | Ýagdaýy | Çeşme |
surnal | 7.40 | galmak 2; Memes: 25 ° C. | (1) ACD |
surnal | 7.39 | ph 3; Memes: 25 ° C. | (1) ACD |
surnal | 7.33 | ph 4; Memes: 25 ° C. | (1) ACD |
surnal | 6.97 | ph 5; Memes: 25 ° C. | (1) ACD |
surnal | 6.15 | ph 6; Memes: 25 ° C. | (1) ACD |
surnal | 5.19 | ph 7; Memes: 25 ° C. | (1) ACD |
surnal | 4.29 | ph 8; Memes: 25 ° C. | (1) ACD |
surnal | 3.77 | ph 9; Memes: 25 ° C. | (1) ACD |
surnal | 3.66 | ph 10; Memes: 25 ° C. | (1) ACD |
dilim | 7.397 ± 0.598 | Memes: 25 ° C. | (1) ACD |
Köpçülikleýin gitmek | 1.3 x 10-4 g / l | Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 1.3 x 10-4 g / l | galasy; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 1.3 x 10-4 g / l | galmak 2; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 1.3 x 10-4 g / l | ph 3; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 1.5 x 10-4 g / l | ph 4; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 3.5 x 10-4 g / l | ph 5; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 2.3 x 10-3 g / l | ph 6; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 0.021 g / l | ph 7; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 0.17 g / l | ph 8; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 0.55 g / l | ph 9; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 0.69 g / l | ph 10; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 1.3 x 10-3 G / L. | Bölünmeýän suw ph ph, 5.73; Memes: 25 ° C. | (1) ACD |
Mollar içerki çözgüt | 2.1 x 10-7 mol / l | Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 2.1 x 10-7 mol / l | galasy; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 2.1 x 10-7 mol / l | galmak 2; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 2.1 x 10-7 mol / l | ph 3; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 2.4 x 10-7 mol / l | ph 4; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 5.5 x 10-7 mol / l | ph 5; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 3.6 x 10-6 mol / l | ph 6; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 3.4 x 10-5 mol / l | ph 7; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 2.7 x 10-4 mol / l | ph 8; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 8.7 x 10-4 mol / l | ph 9; Memes: 25 ° C. | (1) ACD |
Emläk | Bahasy | Ýagdaýy | Çeşme |
Molar selubkasy | 1.1 x 10-3 mol / l | ph 10; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 2.1 x 10-6 mol / l | Bölünmeýän suw ph ph, 5.73; Memes: 25 ° C. | (1) ACD |
Molekulýar agramy | 631.80 | ||
pka | 4.78 ± 0.10 | "Kisidik temp: 25 ° C. | (1) ACD |
pka | -2.33.31 ± 0.60 | Esasy temp: 25 ° C. | (1) ACD |
Bug basyşy | 1.42 x 10-25 torr | Memes: 25 ° C. | (1) ACD |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Dykyzlygy
Emläk | Bahasy | Ýagdaýy | Çeşme |
Dykyzlygy | 1.154 ± 0.06 g / cm3 | Bu bellik: 20 ° C; MEKDEB: 760 torr | (1) ACD |
Woll nukagly | 547.3 ± 3.0 CM3 / mool | Bu bellik: 20 ° C; MEKDEB: 760 torr | (1) ACD |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Lipinski
Emläk | Bahasy | Ýagdaýy | Çeşme |
Erkin aýlanýan baglanyşyklar | 20 | (1) ACD | |
H. | 8 | (1) ACD | |
H donorlar | 2 | (1) ACD | |
H donor / kabul ediji jem | 10 | (1) ACD | |
dilim | 7.397 ± 0.598 | Memes: 25 ° C. | (1) ACD |
Molekulýar agramy | 631.80 |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Gurluşy
Emläk | Bahasy | Ýagdaýy | Çeşme |
Polýar ýer meýdany | 106 A2 | (1) ACD |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Termylal
Emläk | Bahasy | Ýagdaýy | Çeşme |
Gaýnatmak nokady | 779,4 ± 60.0 ° C. | MEKDEB: 760 torr | (1) ACD |
Buglygyň ýanynda | 118.97 ±7 ± 3.0 kJ / mool | MEKDEB: 760 torr | (1) ACD |
Fleşko nokat | 425.2 ± 32.9 ° C. ° C. | (1) ACD |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Spektrler bar
1H nmr
13C nmr