C31h30N2o7 6H-Furo [2 ', 3', AxazyDroSxy], Methylas-7- Mthesyles-7- Methylas-7- Methylas-7- Mthesyl-7- Methylas-7- Methyl-7- Methylas-7- Methyl-7- Mthesyl- (9CI, ACI)

Cov Lus Qhia Yooj Yim:

Xa email rau peb

Khoom Qhia Qhia

Khoom Ntawv

Cov Khoom Siv Lub Cev

Cov Khoom Tseem Ceeb	Tus nqi	Yam tseem ceeb
Molecular hnyav	542.58	-
Boiling taw tes (kwv yees)	692.9 ± 65.0 ° C	XOVXWM: 760 Torr
Ntom ntom (kwv yees)	1.33 ± 0.1 g / cm3	Temp: 20 ° C; XOVXWM: 760 Torr
PKA (kwv yees)	12.51 ± 0.60	Feem ntau acidic temp: 25 ° C

Lwm lub npe thiab cov cim

Canonical smiles o = c1n = c2oc3c (O) CC = CC = CC = CC = CC = CC = CC = CCE
Isomeric smiles c (OC [B @ H] 1o [C @N = CC = CC = CC = CCE (C. CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC = CC =
Tus hauv onei
Inchi = 1s / c31h30N2o7 / C1-19-17-33-29-23) 26 (19) (20-7-5-4 (20-7-13-23 (36-2) 14-10-21
) 22-16-15-24 (37-3) 16-12-22 / h4-17,24h, 18,h3 / 26-, 279- / / M1 / S1
Inchi tus yuam sij
Bqeqceznlikssh-citkvlssa-n
1 Lwm lub npe rau cov khoom siv no
(2R, 3R, 9AR, 9AR) -2 - [methoxyphenyrd)-3-awv-furo [3,2-a] pyrimidin-6-ib (aci)

Sim spectra

Spectra muaj
1h nmr
13C NMR
Qho hnyav

Kwv yees cov thaj chaw

Cov khoom muaj

Kev muaj txuj Ci

Tshuaj

Ceev

Ncauj lus di ncauj

Cov qauv muaj feem xyuam

Thermal

Kev muaj txuj Ci

Ntiag tug	Tus nqi	Yam tseem ceeb	Lub hauv paus
Bioconclivration qhov tseem ceeb	2800	PH 1; Temp: 25 ° C	(1) ACD
Bioconclivration qhov tseem ceeb	2800	PHA 2; Temp: 25 ° C	(1) ACD
Bioconclivration qhov tseem ceeb	2800	PH 3; Temp: 25 ° C	(1) ACD
Bioconclivration qhov tseem ceeb	2800	PH 4; Temp: 25 ° C	(1) ACD
Bioconclivration qhov tseem ceeb	2800	PH 5; Temp: 25 ° C	(1) ACD
Bioconclivration qhov tseem ceeb	2800	p.c; Temp: 25 ° C	(1) ACD
Bioconclivration qhov tseem ceeb	2800	pH 7; Temp: 25 ° C	(1) ACD
Bioconclivration qhov tseem ceeb	2800	PH 8; Temp: 25 ° C	(1) ACD
Bioconclivration qhov tseem ceeb	2800	PH 9; Temp: 25 ° C	(1) ACD
Bioconclivration qhov tseem ceeb	2790	pH 10; Temp: 25 ° C	(1) ACD

Tshuaj

Ntiag tug	Tus nqi	Yam tseem ceeb	Lub hauv paus
Txhim hoom	10200	PH 1; Temp: 25 ° C	(1) ACD
Txhim hoom	10200	PHA 2; Temp: 25 ° C	(1) ACD
Txhim hoom	10200	PH 3; Temp: 25 ° C	(1) ACD
Txhim hoom	10200	PH 4; Temp: 25 ° C	(1) ACD
Txhim hoom	10200	PH 5; Temp: 25 ° C	(1) ACD

Ntiag tug	Tus nqi	Yam tseem ceeb	Lub hauv paus
Txhim hoom	10200	p.c; Temp: 25 ° C	(1) ACD
Txhim hoom	10200	pH 7; Temp: 25 ° C	(1) ACD
Txhim hoom	10200	PH 8; Temp: 25 ° C	(1) ACD
Txhim hoom	10200	PH 9; Temp: 25 ° C	(1) ACD
Txhim hoom	10200	pH 10; Temp: 25 ° C	(1) ACD
logd	4.84	PH 1; Temp: 25 ° C	(1) ACD
logd	4.84	PHA 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	p.c; 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
lub cim	4.839 ± 0.618	Temp: 25 ° C	(1) ACD
Kev ua yeeb yam loj solubility solubility	3.6 x 10-4 g / l	Temp: 25 ° C	(1) ACD
Loj solubility	3.6 x 10-4 g / l	PH 1; Temp: 25 ° C	(1) ACD
Loj solubility	3.6 x 10-4 g / l	PHA 2; Temp: 25 ° C	(1) ACD
Loj solubility	3.6 x 10-4 g / l	PH 3; Temp: 25 ° C	(1) ACD
Loj solubility	3.6 x 10-4 g / l	PH 4; Temp: 25 ° C	(1) ACD
Loj solubility	3.6 x 10-4 g / l	PH 5; Temp: 25 ° C	(1) ACD
Loj solubility	3.6 x 10-4 g / l	p.c; Temp: 25 ° C	(1) ACD
Loj solubility	3.6 x 10-4 g / l	pH 7; Temp: 25 ° C	(1) ACD
Loj solubility	3.6 x 10-4 g / l	PH 8; Temp: 25 ° C	(1) ACD
Loj solubility	3.6 x 10-4 g / l	PH 9; Temp: 25 ° C	(1) ACD
Loj solubility	3.6 x 10-4 g / l	pH 10; Temp: 25 ° C	(1) ACD
Loj solubility	3.6 x 10-4 g / l	Unbuffered dej pH 7.00; Temp: 25 ° C	(1) ACD
Molar intrinsic solubility	6.6 x 10-7 mol / l	Temp: 25 ° C	(1) ACD
Raug solubility	6.6 x 10-7 mol / l	PH 1; Temp: 25 ° C	(1) ACD
Raug solubility	6.6 x 10-7 mol / l	PHA 2; Temp: 25 ° C	(1) ACD
Raug solubility	6.6 x 10-7 mol / l	PH 3; Temp: 25 ° C	(1) ACD

Ntiag tug	Tus nqi	Yam tseem ceeb	Lub hauv paus
Raug solubility	6.6 x 10-7 mol / l	PH 4; Temp: 25 ° C	(1) ACD
Raug solubility	6.6 x 10-7 mol / l	PH 5; Temp: 25 ° C	(1) ACD
Raug solubility	6.6 x 10-7 mol / l	p.c; Temp: 25 ° C	(1) ACD
Raug solubility	6.6 x 10-7 mol / l	pH 7; Temp: 25 ° C	(1) ACD
Raug solubility	6.6 x 10-7 mol / l	PH 8; Temp: 25 ° C	(1) ACD
Raug solubility	6.6 x 10-7 mol / l	PH 9; Temp: 25 ° C	(1) ACD
Raug solubility	6.7 x 10-7 mol / l	pH 10; Temp: 25 ° C	(1) ACD
Raug solubility	6.6 x 10-7 mol / l	Unbuffered dej pH 7.00; Temp: 25 ° C	(1) ACD
Molecular hnyav	542.58
pa kua muag	12.51 ± 0.60	Feem ntau acidic temp: 25 ° C	(1) ACD
pa kua muag	-4.38 ± 0.60	Feem ntau cov sam luam: 25 ° C	(1) ACD
Vapor siab	3.73 X 10-20	Temp: 25 ° C	(1) ACD

Ceev

Ntiag tug	Tus nqi	Yam tseem ceeb	Lub hauv paus
Ceev	1.33 ± 0.1 g / cm3	Temp: 20 ° C; XOVXWM: 760 Torr	(1) ACD
Cov pob zeb ntim	404.9 ± 7.0 CM3 / Mol	Temp: 20 ° C; XOVXWM: 760 Torr	(1) ACD

Ncauj lus di ncauj

Ntiag tug	Tus nqi	Yam tseem ceeb	Lub hauv paus
Dawb doatable bonds	9		(1) ACD
H neeg txais	9		(1) ACD
H pub dawb	1		(1) ACD
H pub dawb / txais nyiaj	10		(1) ACD
lub cim	4.839 ± 0.618	Temp: 25 ° C	(1) ACD
Molecular hnyav	542.58

Cov qauv muaj feem xyuam

Ntiag tug	Tus nqi	Yam tseem ceeb	Lub hauv paus
Polar Thaj Chaw Thaj Chaw	99.1 A2	(1) ACD

Thermal

Ntiag tug	Tus nqi	Yam tseem ceeb	Lub hauv paus
Kub taw tes	692.9 ± 65.0 ° C	XOVXWM: 760 Torr	(1) ACD
Enthalpy ntawm vaporization	106.61 ± 3.0 KJ / MOL	XOVXWM: 760 Torr	(1) ACD
Flash point	372,8 ± 34.3 ° C		(1) ACD