C42h39n3o8 entek berilmedi
Esasy fiziki aýratynlyklary | Bahasy | Ýagdaýy |
Molekulýar agramy | 713.78 | - |
Dykyzlygy (çak edilýär) | 1.315 ± 0.06 g / cm3 | Bu bellik: 20 ° C; MEKDEB: 760 torr |
pka (çak edilýär) | 8.23 ± 0.10 | "Kisidik temp: 25 ° C. |
Kanoniki ýylgyrýar O = c1NC (= O) n (c = c1c = CC = CC32) (C6 = CC = CC = CC = CC = CC = CC = CC = C (O) c (o) C.C (O) CC.
ISOMICICK ýylgyrýar
C (OC [C @ H] 1O [c @ h] 1o) (c [h) (c f / cc = c (c5 = cc = c)
Inchi
InChI=1S/C42H39N3O8/c1-50-32-19-15-30(16-20-32)42(29-12-4-3-5-13-29,31-17-21-33(51-2)22-18-31)52-26-37-36(46)23-38(53-37)4 5-25-35 (40-35 (40-35 (48) 49-34) 28 (47) 28-34 (27) 28,33) 28,36) 28,36,34,26H, 23-23,26H2,26H, 4-246H2,46H, 4-24,47) (H, 44,48,49) / T36-, 37 + 38 + 3 / M0 / S1
Inchi açary
Hdumrqqrryjorbf-Yxwiýcfasa-n
Elýeterli häsiýetler |
Biologiki |
Elýeterli häsiýetler |
Himiki |
Dykyzlygy |
Lipinski |
Gurluşy |
Biologiki
Emläk | Bahasy | Ýagdaýy | Çeşme |
Bionokententrasiýa faktory | 41700 | galasy; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 41700 | galmak 2; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 41700 | ph 3; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 41700 | ph 4; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 41700 | ph 5; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 41200 | ph 6; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 36900 | ph 7; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 18100 | ph 8; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 3290 | ph 9; Memes: 25 ° C. | (1) ACD |
Bionokententrasiýa faktory | 718 | 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 | 70600 | galasy; Memes: 25 ° C. | (1) ACD |
KOK | 70600 | galmak 2; Memes: 25 ° C. | (1) ACD |
KOK | 70600 | ph 3; Memes: 25 ° C. | (1) ACD |
KOK | 70600 | ph 4; Memes: 25 ° C. | (1) ACD |
KOK | 70500 | ph 5; Memes: 25 ° C. | (1) ACD |
KOK | 69700 | ph 6; Memes: 25 ° C. | (1) ACD |
KOK | 62400 | ph 7; Memes: 25 ° C. | (1) ACD |
KOK | 30600 | ph 8; Memes: 25 ° C. | (1) ACD |
KOK | 5560 | ph 9; Memes: 25 ° C. | (1) ACD |
KOK | 1210 | ph 10; Memes: 25 ° C. | (1) ACD |
surnal | 6.38 | galasy; Memes: 25 ° C. | (1) ACD |
surnal | 6.38 | galmak 2; Memes: 25 ° C. | (1) ACD |
surnal | 6.38 | ph 3; Memes: 25 ° C. | (1) ACD |
Emläk | Bahasy | Ýagdaýy | Çeşme |
surnal | 6.38 | ph 4; Memes: 25 ° C. | (1) ACD |
surnal | 6.38 | ph 5; Memes: 25 ° C. | (1) ACD |
surnal | 6.38 | ph 6; Memes: 25 ° C. | (1) ACD |
surnal | 6.33 | ph 7; Memes: 25 ° C. | (1) ACD |
surnal | 6.02 | ph 8; Memes: 25 ° C. | (1) ACD |
surnal | 5.28 | ph 9; Memes: 25 ° C. | (1) ACD |
surnal | 4.62 | ph 10; Memes: 25 ° C. | (1) ACD |
dilim | 6.382 ± 0.644 | Memes: 25 ° C. | (1) ACD |
Köpçülikleýin gitmek | 5.1 x 10-7 g / l | Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 5.1 x 10-7 g / l | galasy; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 5.1 x 10-7 g / l | galmak 2; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 5.1 x 10-7 g / l | ph 3; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 5.1 x 10-7 g / l | ph 4; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 5.1 x 10-7 g / l | ph 5; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 5.1 x 10-7 g / l | ph 6; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 5.7 x 10-7 g / l | ph 7; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 1.1 x 10-6 g / l | ph 8; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 6.4 x 10-6 g / l | ph 9; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 2.9 x 10-5 g / l | ph 10; Memes: 25 ° C. | (1) ACD |
Köpçülikleýin çözelbet | 5.7 x 10-7 g / l | Siňdirilmedik suw ph ph 7.00; Memes: 25 ° C. | (1) ACD |
Mollar içerki çözgüt | 7.1 x 10-10 mol / l | Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 7.1 x 10-10 mol / l | galasy; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 7.1 x 10-10 mol / l | galmak 2; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 7.1 x 10-10 mol / l | ph 3; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 7.1 x 10-10 mol / l | ph 4; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 7.1 x 10-10 mol / l | ph 5; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 7.2 x 10-10 mol / l | ph 6; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 8.0 x 10-10 mol / l | ph 7; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 1.6 x 10-9 mol / l | ph 8; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 9.0 x 10-9 mol / l | ph 9; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 4.1 x 10-8 mol / l | ph 10; Memes: 25 ° C. | (1) ACD |
Molar selubkasy | 8.0 x 10-10 mol / l | Siňdirilmedik suw ph ph 7.00; Memes: 25 ° C. | (1) ACD |
Emläk | Bahasy | Ýagdaýy | Çeşme |
Molekulýar agramy | 713.78 | ||
pka | 8.23 ± 0.10 | "Kisidik temp: 25 ° C. | (1) ACD |
pka | -1.90 ± 0.20 | Esasy temp: 25 ° C. | (1) ACD |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Dykyzlygy
Emläk | Bahasy | Ýagdaýy | Çeşme |
Dykyzlygy | 1.315 ± 0.06 g / cm3 | Bu bellik: 20 ° C; MEKDEB: 760 torr | (1) ACD |
Woll nukagly | 542.7 ± 3.0 Cm3 / mol | 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 | 13 | (1) ACD | |
H. | 11 | (1) ACD | |
H donorlar | 3 | (1) ACD | |
H donor / kabul ediji jem | 14 | (1) ACD | |
dilim | 6.382 ± 0.644 | Memes: 25 ° C. | (1) ACD |
Molekulýar agramy | 713.78 |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Gurluşy
Emläk | Bahasy | Ýagdaýy | Çeşme |
Polýar ýer meýdany | 136 A2 | (1) ACD |
(1) Gowrän himiýa ösüşini (ACD / Labors) programma üpjünçiligini (© 1994-20233 ACD / laboratoriýa) arkaly hasaplanýar
Spektrler bar
1H nmr
13C nmr