C13H19n5O5 Adénosine, 2 '-o- (2-Methoxyletl) - (9ci, ACI) GAMPANG

C13H19N5N5O5 Adénosine, 2 '-o- (2-Methoxyocyletly) - (9ci, Aci)

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CAT Nomer Pendaptaran

168427-74-5

Sipat fisik konci	Nilai	Kaayaan
Beurat molekular	325.32	-
Titik ngagolak (diprediksi)	639.0 ± 65.0 ° C	Pencét: 760 Torr
Kapadetan (diprediksi)	1.70 ± 0,1 g / cm3	Temp: 20 ° C; Pencét: 760 Torr
Pair (diprediksi)	13.12 ± 0.70	TEMP anu paling asam: 25 ° C

Ngaran sareng identifikasi

Imut

Dibobol (n2c = nc = 3c (= nc = nc32) n) c (karpol) c1o

Imutterik

O (CCOC) [C @ H] 1 [C @@) (O [C @ H] (CO) [C @

Atchi

Inchi = 1s / C13H19n5O5O5 / C1-21-22-12-10-9 (20) 7) 23-13) 23-13,13,14,10,17,1,7,1.8,1,10,17,1,7,1,7,1,7,1,7,1,7,1.1.14,5,7,1,7,5,1,7,5,1,7,5,1,7,5,7,1,13,5,7,1,7,5,1,7,5.1h3, (H2,14,15,16) / T7-, 9-, 10-, 13- / M1 / S1

Konci inci

Pudxujrjrjibling-qyvstilmSa-n

1 ngaran sanés pikeun zat ieu

2 '-O- (2-Metoxylethl) Adenosine (ACI)

Spéktra sayogi
1 h nmr
13 c nmr

Diulalkeun sipat

Sipat sayogi
Biologis
Kimia
Perténaran
Lipinski
Struktur patali
Theresalia

Biologis

Harta	Nilai	Kaayaan	Sumber
Faktor bioconcation	1.0	pH 1; Temp: 25 ° C	(1) ACD
Faktor bioconcation	1.0	pH 2; Temp: 25 ° C	(1) ACD
Faktor bioconcation	1.0	pH 3; Temp: 25 ° C	(1) ACD
Faktor bioconcation	1.0	pH 4; Temp: 25 ° C	(1) ACD
Faktor bioconcation	1.18	pH 5; Temp: 25 ° C	(1) ACD
Faktor bioconcation	1.31	pH 6; Temp: 25 ° C	(1) ACD
Faktor bioconcation	1.32	pH 7; Temp: 25 ° C	(1) ACD
Faktor bioconcation	1.32	pH 8; Temp: 25 ° C	(1) ACD
Faktor bioconcation	1.32	pH 9; Temp: 25 ° C	(1) ACD
Faktor bioconcation	1.32	pH 10; Temp: 25 ° C	(1) ACD

(1) Diitung nganggo pangembangan kimia maju (ACD / Lab) Software v11.02 (© 199-202 Acd / LCS)

Kimia

Harta	Nilai	Kaayaan	Sumber
Kub	1.0	pH 1; Temp: 25 ° C	(1) ACD
Kub	1.0	pH 2; Temp: 25 ° C	(1) ACD
Kub	3.39	pH 3; Temp: 25 ° C	(1) ACD
Kub	19.4	pH 4; Temp: 25 ° C	(1) ACD
Kub	38.0	pH 5; Temp: 25 ° C	(1) ACD
Kub	42.0	pH 6; Temp: 25 ° C	(1) ACD
Kub	42,5	pH 7; Temp: 25 ° C	(1) ACD

Harta	Nilai	Kaayaan	Sumber
Kub	42,5	pH 8; Temp: 25 ° C	(1) ACD
Kub	42,5	pH 9; Temp: 25 ° C	(1) ACD
Kub	42,5	pH 10; Temp: 25 ° C	(1) ACD
log As	-1.94	pH 1; Temp: 25 ° C	(1) ACD
log As	-1.48	pH 2; Temp: 25 ° C	(1) ACD
log As	-0.64	pH 3; Temp: 25 ° C	(1) ACD
log As	0,12	pH 4; Temp: 25 ° C	(1) ACD
log As	0,41	pH 5; Temp: 25 ° C	(1) ACD
log As	0,46	pH 6; Temp: 25 ° C	(1) ACD
log As	0,46	pH 7; Temp: 25 ° C	(1) ACD
log As	0,46	pH 8; Temp: 25 ° C	(1) ACD
log As	0,46	pH 9; Temp: 25 ° C	(1) ACD
log As	0,46	pH 10; Temp: 25 ° C	(1) ACD
logp	0,462 ± 0.647	Temp: 25 ° C	(1) ACD
Kebar intrinsik massic	4.2 g / l	Temp: 25 ° C	(1) ACD
Sahubat massa	999 g / l	pH 1; Temp: 25 ° C	(1) ACD
Sahubat massa	381 g / l	pH 2; Temp: 25 ° C	(1) ACD
Sahubat massa	55 g / l	pH 3; Temp: 25 ° C	(1) ACD
Sahubat massa	9.4 g / l	pH 4; Temp: 25 ° C	(1) ACD
Sahubat massa	4.9 g / l	pH 5; Temp: 25 ° C	(1) ACD
Sahubat massa	4.2 g / l	pH 6; Temp: 25 ° C	(1) ACD
Sahubat massa	4.2 g / l	pH 7; Temp: 25 ° C	(1) ACD
Sahubat massa	4.2 g / l	pH 8; Temp: 25 ° C	(1) ACD
Sahubat massa	4.2 g / l	pH 9; Temp: 25 ° C	(1) ACD
Sahubat massa	4.2 g / l	pH 10; Temp: 25 ° C	(1) ACD
Sahubat massa	4.2 g / l	Cai pH 8.08; Temp: 25 ° C	(1) ACD
Kebar intrinsik molar	0,013 mol / l	Temp: 25 ° C	(1) ACD
Kahirupan molar	3.07 mol / l	pH 1; Temp: 25 ° C	(1) ACD
Kahirupan molar	1,17 mol / l	pH 2; Temp: 25 ° C	(1) ACD
Kahirupan molar	0.17 mol / l	pH 3; Temp: 25 ° C	(1) ACD
Kahirupan molar	0,029 mol / l	pH 4; Temp: 25 ° C	(1) ACD
Kahirupan molar	0,015 mol / l	pH 5; Temp: 25 ° C	(1) ACD

Harta	Nilai	Kaayaan	Sumber
Kahirupan molar	0,013 mol / l	pH 6; Temp: 25 ° C	(1) ACD
Kahirupan molar	0,013 mol / l	pH 7; Temp: 25 ° C	(1) ACD
Kahirupan molar	0,013 mol / l	pH 8; Temp: 25 ° C	(1) ACD
Kahirupan molar	0,013 mol / l	pH 9; Temp: 25 ° C	(1) ACD
Kahirupan molar	0,013 mol / l	pH 10; Temp: 25 ° C	(1) ACD
Kahirupan molar	0,013 mol / l	Cai pH 8.08; Temp: 25 ° C	(1) ACD
Beurat molekular	325.32
Pka	13.12 ± 0.70	TEMP anu paling asam: 25 ° C	(1) ACD
Pka	3.82 ± 0,10	Paling dasar temp: 25 ° C	(1) ACD
Tekenan uap	3.35 x 10-17 torr	Temp: 25 ° C	(1) ACD

(1) Diitung nganggo pangembangan kimia maju (ACD / Lab) Software v11.02 (© 199-202 Acd / LCS)

Perténaran

Harta	Nilai	Kaayaan	Sumber
Perténaran	1.70 ± 0,1 g / cm3	Temp: 20 ° C; Pencét: 760 Torr	(1) ACD
Masar	191.2 ± 7.0 cm3 / mol	Temp: 20 ° C; Pencét: 760 Torr	(1) ACD

Lipinski

Harta	Nilai	Kaayaan	Sumber
Beungkeut bébas rotét	8		(1) ACD
H panarima	10		(1) ACD
H donor	4		(1) ACD
H donor / panarima	14		(1) ACD
logp	0,462 ± 0.647	Temp: 25 ° C	(1) ACD
Beurat molekular	325.32

Struktur patali

Harta	Nilai	Sumber kaayaan
Daérah permukaan polar	138 A2	(1) ACD

Harta	Nilai	Kaayaan	Sumber
Titik anu ngagolak	639.0 ± 65.0 ° C	Pencét: 760 Torr	(1) ACD
Enthalpy tina vaporisasi	99.17 ± 3.0 kJ / mol	Pencét: 760 Torr	(1) ACD
Titik kaingetan	340.2 ± 34.3 ° C		(1) ACD