C11H16N6O4 Adenozin, 2-amin-2 ′ -O-metil- (9CI, ACI)

Esasy maglumatlar:

Bize e-poçta iberiň

Önümiň jikme-jigi

Haryt bellikleri

Madda maglumatlary

CAS Hasaba alyş belgisi

80791-87-3

Esasy fiziki aýratynlyklar	Gymmatlyk	.Agdaý
Molekulýar agram	296.28	-
Eriş nokady (Tejribe)	121-122 ° C.	Solvent: Metanol
Gaýnadyş nokady (çak edilýär)	733.2 ± 70.0 ° C.	Metbugat: 760 Torr
Dykyzlygy (çak edilýär)	1,98 ± 0,1 g / sm3	Temp: 20 ° C;Metbugat: 760 Torr
pKa (çak edilýär)	13.12 ± 0.70	Kislotaly templeriň köpüsi: 25 ° C.

Beýleki atlar we kesgitleýjiler

Kanoniki SMILES

OCC1OC (N2C = NC = 3C (= NC (= NC32) N) N) C (OC) C1O

Izomeriki SMILES

O (C) [C @ H] 1 [C @ H] (N2C = 3C (N = C2) = C (N) N = C (N) N3) O [C @ H] (CO) [C @ H ] 1O

InChI

InChI = 1S / C11H16N6O4 / c1-20-7-6 (19) 4 (2-18) 21-10 (7) 17-3-14-5-8 (12) 15-11 (13) 16-9 ( 5) 17 / h3-4,6-7,10,18-19H, 2H2,1H3, (H4,12,13,15,16) / t4-, 6-, 7-, 10- / m1 / s1

InChI açary

JLWUWXCKSOIFPS-KQYNXXCUSA-N

2 Bu maddanyň beýleki atlary

2-Amino-2 ′ -O-metiladenozin (ACI);2 ′ -O-Metil-2,6-diaminopurin ribosidi
Sypatlar bar
Malylylyk

Malylylyk

Emläk	Gymmatlyk	.Agdaý	Çeşme
Eriş nokady	121-122 ° C.	Solvent: Metanol	(1) CAS

(1) Kore, Anilkumar R.;Nukleozidler, nukleotidler we nuklein kislotalary, (2006), 25 (3), 307-314, CAplus

Synag spektri

Spektralar bar
UV we görünýän

Çaklanylýan häsiýetler

Sypatlar bar
Biologiki
Himiki
Dykyzlygy
Lipinski
Gurluşy bilen baglanyşykly
Malylylyk

Biologiki

Emläk	Gymmatlyk	.Agdaý	Çeşme
Biokonsentrasiýa faktory	1.0	pH 1;Temp: 25 ° C.	(1) ACD
Biokonsentrasiýa faktory	1.0	pH 2;Temp: 25 ° C.	(1) ACD
Biokonsentrasiýa faktory	1.0	pH 3;Temp: 25 ° C.	(1) ACD
Biokonsentrasiýa faktory	1.0	pH 4;Temp: 25 ° C.	(1) ACD
Biokonsentrasiýa faktory	1.0	pH 5;Temp: 25 ° C.	(1) ACD
Biokonsentrasiýa faktory	1.0	pH 6;Temp: 25 ° C.	(1) ACD
Biokonsentrasiýa faktory	1.0	pH 7;Temp: 25 ° C.	(1) ACD
Biokonsentrasiýa faktory	1.0	pH 8;Temp: 25 ° C.	(1) ACD
Biokonsentrasiýa faktory	1.0	pH 9;Temp: 25 ° C.	(1) ACD
Biokonsentrasiýa faktory	1.0	pH 10;Temp: 25 ° C.	(1) ACD

Gozgalmaýan emläk bahasynyň çeşmesi

Koc 1.0 pH 1;Temp: 25 ° C (1) ACD

Koc 1.0 pH 2;Temp: 25 ° C (1) ACD

Koc 1.0 pH 3;Temp: 25 ° C (1) ACD

Koc 1.21 pH 4;Temp: 25 ° C (1) ACD

Koc 6.90 pH 5;Temp: 25 ° C (1) ACD

Koc 13.5 pH 6;Temp: 25 ° C (1) ACD

Koc 14,9 pH 7;Temp: 25 ° C (1) ACD

Koc 15.1 pH 8;Temp: 25 ° C (1) ACD

Koc 15.1 pH 9;Temp: 25 ° C (1) ACD

Koc 15.1 pH 10;Temp: 25 ° C (1) ACD

logD -2.85 pH 1;Temp: 25 ° C (1) ACD

logD -2.76 pH 2;Temp: 25 ° C (1) ACD

logD -2.31 pH 3;Temp: 25 ° C (1) ACD

logD -1.46 pH 4;Temp: 25 ° C (1) ACD

logD -0.70 pH 5;Temp: 25 ° C (1) ACD

logD -0.41 pH 6;Temp: 25 ° C (1) ACD

logD -0.37 pH 7;Temp: 25 ° C (1) ACD

logD -0.36 pH 8;Temp: 25 ° C (1) ACD

logD -0.36 pH 9;Temp: 25 ° C (1) ACD

logD -0.36 pH 10;Temp: 25 ° C (1) ACD

logP -0.363 ± 0.611 Temp: 25 ° C (1) ACD

Massanyň içerki çözgüdi 1,6 g / L Temp: 25 ° C (1) ACD

Massanyň çözgüdi 504 g / L pH 1;Temp: 25 ° C (1) ACD

Massanyň çözgüdi 409 g / L pH 2;Temp: 25 ° C (1) ACD

Massanyň çözgüdi 140 g / L pH 3;Temp: 25 ° C (1) ACD

Massanyň çözgüdi 20 g / L pH 4;Temp: 25 ° C (1) ACD

Köpçülikleýin çözüliş 3,6 g / L pH 5;Temp: 25 ° C (1) ACD

Massanyň çözgüdi 1.8 g / L pH 6;Temp: 25 ° C (1) ACD

Massanyň çözgüdi 1,7 g / L pH 7;Temp: 25 ° C (1) ACD

Köpçülikleýin çözüliş 1,6 g / L pH 8;Temp: 25 ° C (1) ACD

Massanyň çözülişi 1,6 g / L pH 9;Temp: 25 ° C (1) ACD

Massanyň çözülişi 1,6 g / L pH 10;Temp: 25 ° C (1) ACD

Dykyzlygy

Emläk	Gymmatlyk	.Agdaý	Çeşme
Dykyzlygy	1,98 ± 0,1 g / sm3	Temp: 20 ° C;Metbugat: 760 Torr	(1) ACD
Molar göwrümi	149.3 ± 7.0 sm3 / mol	Temp: 20 ° C;Metbugat: 760 Torr	(1) ACD

Lipinski

Emläk	Gymmatlyk	.Agdaý	Çeşme
Erkin aýlanýan obligasiýalar	5		(1) ACD
H kabul edijiler	10		(1) ACD
H Donorlar	6		(1) ACD
H Donor / kabul ediji jem	16		(1) ACD
logP	-0.363 ± 0.611	Temp: 25 ° C.	(1) ACD
Molekulýar agram	296.28