C48h54O8P Adenosine, N-Benzoyl-5 '-Igisimba (4-Igikoresho (1' - 1 '- Indirimbo ya Metileyly n, N-BI). ACI)

ibicuruzwa

C48h54O8P Adenosine, N-Benzoyl-5 '-Igisimba (4-Igikoresho (1' - 1 '- Indirimbo ya Metileyly n, N-BI). ACI)

Amakuru y'ibanze:


Ibisobanuro birambuye

Ibicuruzwa

Ibisobanuro birambuye

Umubare wa kabiri

110782-31-5

H335, H331, H319, H315, H311, H311, H311 + H311, H301

Imbaraga z'umubiri Agaciro Imiterere
Uburemere bwa molekile 887.96 -
PKA (byahanuwe) 7.87 ± 0.43 Acide menshi: 25 ° C.

Andi mazina n'ibiranga

Inseko ya kanonical

N # CCCOP (OC1C (OC (N2C = NC = 3C (= NC32) NC (CC = CC = CC = CC = CC) C. C. C. C. C. C.

Isomenic kumwenyura

C (OC [C @@ H] 1 [C @@ (n (cc (cc (cc (cc = cc = cc3) (c5 = cc = C(OC)C=C5)(C6=CC=C(OC)C=C6)C7=CC=CC=C7

Inchi

Inchi = 1s / c48h5444o8p / c1-32 (2) 55 (33 (31-49) 59-7 (42-49 (41) 54) 53-46 (5 6) 34-15-10-8-16-34) 29-60-48 (35-17-12-9-13-35-9-35,36-36) 2-20-36) 37-25-37 / H8-36.140.40-33 2-43,47h, 14,28-29h2,1-7h3, (h, 50,53.53,53.56) / T40-, 47-, 434? / M1 / ​​S1

Inchi

Azcgonuypxhmj-psvhyzmasa-n

2 Andi mazina kuriyi ngingo

Adenosine,N-Benzoyl-5 '-O- [Bis (4-Uburyo bwa Ocfaxypyl) phenylmethyl] -2 '-O-Urubuga -, 3 '- 2-cyanoethyl Bis (1-methyyl) fosiphorage] (9Ci); 5 '-O- (4,4 '-DeteThoxytrityl) -N6-Benzoyl-2' -O-Methyladesosonine 3 '- (2-cyanoethyylN,N-diopropylphosphoshorashimite)

Imyitozo ngororamubiri

Spectra irahari
13 c nmr
Hetero nmr
Misa

Ibiranga byahanuwe

Ibyiza birahari
Ibinyabuzima
Imiti
Lipinski
Imiterere

Ibinyabuzima

Umutungo Agaciro Imiterere Isoko
BioConcentration 4050 ph 1; Temp: 25 ° C. (1) acd
BioConcentration 1.08 x 105 ph 2; Temp: 25 ° C. (1) acd
BioConcentration 1.00 x 106 ph 3; Temp: 25 ° C. (1) acd
BioConcentration 1.00 x 106 ph 4; Temp: 25 ° C. (1) acd
BioConcentration 1.00 x 106 ph 5; Temp: 25 ° C. (1) acd
BioConcentration 1.00 x 106 pH 6; Temp: 25 ° C. (1) acd
BioConcentration 1.00 x 106 pH 7; Temp: 25 ° C. (1) acd
BioConcentration 1.00 x 106 ph 8; Temp: 25 ° C. (1) acd
BioConcentration 2.10 x 105 pH 9; Temp: 25 ° C. (1) acd
BioConcentration 60800 PH 10; Temp: 25 ° C. (1) acd

(1) kubarwa ukoresheje iterambere rya chimie ihamye (acd / laboratwari) software v11.02 (© 1994-2023 acd

Imiti

Umutungo Agaciro Imiterere Isoko
Koc 1830 ph 1; Temp: 25 ° C. (1) acd
Koc 48700 ph 2; Temp: 25 ° C. (1) acd
Koc 4.91 x 105 ph 3; Temp: 25 ° C. (1) acd
Koc 1.52 x 106 ph 4; Temp: 25 ° C. (1) acd
Koc 1.90 x 106 ph 5; Temp: 25 ° C. (1) acd
Koc 1.91 x 106 pH 6; Temp: 25 ° C. (1) acd
Koc 1.57 x 106 pH 7; Temp: 25 ° C. (1) acd

 

Umutungo Agaciro Imiterere Isoko
Koc 5.78 X 105 ph 8; Temp: 25 ° C. (1) acd
Koc 95000 pH 9; Temp: 25 ° C. (1) acd
Koc 27500 PH 10; Temp: 25 ° C. (1) acd
Logd 6.01 ph 1; Temp: 25 ° C. (1) acd
Logd 7.43 ph 2; Temp: 25 ° C. (1) acd
Logd 8.44 ph 3; Temp: 25 ° C. (1) acd
Logd 8.93 ph 4; Temp: 25 ° C. (1) acd
Logd 9.02 ph 5; Temp: 25 ° C. (1) acd
Logd 9.02 pH 6; Temp: 25 ° C. (1) acd
Logd 8.94 pH 7; Temp: 25 ° C. (1) acd
Logd 8.51 ph 8; Temp: 25 ° C. (1) acd
Logd 7.72 pH 9; Temp: 25 ° C. (1) acd
Logd 7.18 PH 10; Temp: 25 ° C. (1) acd
LogP 9.038 ± 0.723 Temp: 25 ° C. (1) acd
Misa yimbere 1.4 x 10-5 g / l Temp: 25 ° C. (1) acd
Rusange 0.014 g / l ph 1; Temp: 25 ° C. (1) acd
Rusange 5.3 x 10-4 g / l ph 2; Temp: 25 ° C. (1) acd
Rusange 5.3 x 10-5 g / l ph 3; Temp: 25 ° C. (1) acd
Rusange 1.7 x 10-5 g / l ph 4; Temp: 25 ° C. (1) acd
Rusange 1.3 X 10-5 G / L. ph 5; Temp: 25 ° C. (1) acd
Rusange 1.3 X 10-5 G / L. pH 6; Temp: 25 ° C. (1) acd
Rusange 1.7 x 10-5 g / l pH 7; Temp: 25 ° C. (1) acd
Rusange 4.5 x 10-5 g / l ph 8; Temp: 25 ° C. (1) acd
Rusange 2.8 x 10-4 g / l pH 9; Temp: 25 ° C. (1) acd
Rusange 9.8 x 10-4 g / l PH 10; Temp: 25 ° C. (1) acd
Rusange 1.7 x 10-5 g / l Itanu y'amazi ya ph 6.99; Temp: 25 ° C. (1) acd
Morlar Mainsic Lowelity 1.6 x 10-8 mol / l Temp: 25 ° C. (1) acd
Umuryango wawe 1.6 x 10-5 Mol / l ph 1; Temp: 25 ° C. (1) acd
Umuryango wawe 6.0 x 10-7 mol / l ph 2; Temp: 25 ° C. (1) acd
Umuryango wawe 6.0 x 10-8 mol / l ph 3; Temp: 25 ° C. (1) acd
Umuryango wawe 1.9 x 10-8 mol / l ph 4; Temp: 25 ° C. (1) acd
Umuryango wawe 1.5 x 10-8 mol / l ph 5; Temp: 25 ° C. (1) acd

 

Umutungo Agaciro Imiterere Isoko
Umuryango wawe 1.5 x 10-8 mol / l pH 6; Temp: 25 ° C. (1) acd
Umuryango wawe 1.9 x 10-8 mol / l pH 7; Temp: 25 ° C. (1) acd
Umuryango wawe 5.1 x 10-8 mol / l ph 8; Temp: 25 ° C. (1) acd
Umuryango wawe 3.1 x 10-7 mol / l pH 9; Temp: 25 ° C. (1) acd
Umuryango wawe 1.1 x 10-6 mol / l PH 10; Temp: 25 ° C. (1) acd
Umuryango wawe 1.9 x 10-8 mol / l Itanu y'amazi ya ph 6.99; Temp: 25 ° C. (1) acd
Uburemere bwa molekile 887.96    
PKA 7.87 ± 0.43 Acide menshi: 25 ° C. (1) acd
PKA 3.45 ± 0.70 Icyiciro cyibanze: 25 ° C. (1) acd

(1) kubarwa ukoresheje iterambere rya chimie ihamye (acd / laboratwari) software v11.02 (© 1994-2023 acd

Lipinski

Umutungo Agaciro Imiterere Isoko
Ubusambanyi bwuzuye 19   (1) acd
H yemera 15   (1) acd
H 1   (1) acd
H umuterankunga / kubyemera 16   (1) acd
LogP 9.038 ± 0.723 Temp: 25 ° C. (1) acd
Uburemere bwa molekile 887.96    

(1) kubarwa ukoresheje iterambere rya chimie ihamye (acd / laboratwari) software v11.02 (© 1994-2023 acd

Imiterere

Umutungo Agaciro Inkomoko
Agace k'amashanyarazi 178 A2 (1) acd

(1) kubarwa ukoresheje iterambere rya chimie ihamye (acd / laboratwari) software v11.02 (© 1994-2023 acd

Spectra

Spectra irahari
1 h nmr
13 c nmr

GHS Ingaruka

Kode Imvugo ya hazard Isoko
H335 Birashobora gutera uburakari Impuguke

 

Kode Imvugo ya hazard Isoko
H331 Uburozi iyo uhumetse Impuguke
H319 Itera uburakari bukomeye Impuguke
H315 Itera uburakari Impuguke
H311 Uburozi mu guhuza uruhu Impuguke
H301 + H311 + H331 Uburozi iyo bamizwe, guhura nuruhu cyangwa guhumeka Impuguke
H301 Uburozi iyo bamizwe Impuguke

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