C11H16N6O4 Adenosine, 2-amino-2′-O-methyl- (9CI, ACI)

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C11H16N6O4 Adenosine, 2-amino-2′-O-methyl- (9CI, ACI)

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Bayanin Abu

Lambar Rijistar CAS

80791-87-3

Mabuɗin Abubuwan Jiki Daraja Yanayi
Nauyin Kwayoyin Halitta 296.28 -
Wurin narkewa (Gwaji) 121-122 ° C Mai narkewa: methanol
Wurin tafasa (An annabta) 733.2±70.0 °C Latsa: 760 Torr
Girma (An annabta) 1.98± 0.1 g/cm3 Zazzabi: 20 ° C; Latsa: 760 Torr
pKa (An annabta) 13.12± 0.70 Mafi yawan zafin jiki: 25 ° C

Sauran Sunaye da Masu Ganewa

MURMUSHI na Canonical

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

MURMUSHI

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 Key

JLWUWXCKSOIFPS-KQYNXXCUSA-N

2 Wasu Sunaye na wannan Abu

2-Amin-2'-O- methyladenosine (ACI); 2'-OMethyl-2,6-diaminopurine riboside
Properties akwai
Thermal

Thermal

Dukiya Daraja Yanayi Source
Matsayin narkewa 121-122 ° C Mai narkewa: methanol (1) CAS

(1) Kore, Anilkumar R.; Nucleosides, Nucleotides & Nucleic Acids, (2006), 25 (3), 307-314, CAplus

Spectra na Gwaji

Spectra akwai
UV da Ganuwa

Kayayyakin Hasashen

Properties akwai
Halittu
Chemical
Yawan yawa
Lipinski
Tsarin Yanayi
Thermal

Halittu

Dukiya Daraja Yanayi Source
Factor na Bioconcentration 1.0 pH da 1; Zazzabi: 25 ° C (1) ACD
Factor na Bioconcentration 1.0 pH da 2; Zazzabi: 25 ° C (1) ACD
Factor na Bioconcentration 1.0 pH da 3; Zazzabi: 25 ° C (1) ACD
Factor na Bioconcentration 1.0 pH da 4; Zazzabi: 25 ° C (1) ACD
Factor na Bioconcentration 1.0 pH da 5; Zazzabi: 25 ° C (1) ACD
Factor na Bioconcentration 1.0 pH da 6; Zazzabi: 25 ° C (1) ACD
Factor na Bioconcentration 1.0 pH da 7; Zazzabi: 25 ° C (1) ACD
Factor na Bioconcentration 1.0 pH da 8; Zazzabi: 25 ° C (1) ACD
Factor na Bioconcentration 1.0 pH da 9; Zazzabi: 25 ° C (1) ACD
Factor na Bioconcentration 1.0 pH 10; Zazzabi: 25 ° C (1) ACD

(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Tushen Halin Ƙimar Dukiya
koc 1.0 pH 1; Zazzabi: 25 °C (1) ACD
koc 1.0 pH 2; Zazzabi: 25 °C (1) ACD
koc 1.0 pH 3; Zazzabi: 25 °C (1) ACD
Koc 1.21 pH 4; Zazzabi: 25 °C (1) ACD
Koc 6.90 pH 5; Zazzabi: 25 °C (1) ACD
Koc 13.5 pH 6; Zazzabi: 25 °C (1) ACD
Koc 14.9 pH 7; Zazzabi: 25 °C (1) ACD
Koc 15.1 pH 8; Zazzabi: 25 °C (1) ACD
Koc 15.1 pH 9; Zazzabi: 25 °C (1) ACD
Koc 15.1 pH 10; Zazzabi: 25 ° C (1) ACD
logD -2.85 pH 1; Zazzabi: 25 °C (1) ACD
logD -2.76 pH 2; Zazzabi: 25 °C (1) ACD
logD -2.31 pH 3; Zazzabi: 25 °C (1) ACD
logD -1.46 pH 4; Zazzabi: 25 °C (1) ACD
logD -0.70 pH 5; Zazzabi: 25 °C (1) ACD
logD -0.41 pH 6; Zazzabi: 25 °C (1) ACD
logD -0.37 pH 7; Zazzabi: 25 °C (1) ACD
logD -0.36 pH 8; Zazzabi: 25 °C (1) ACD
logD -0.36 pH 9; Zazzabi: 25 °C (1) ACD
logD -0.36 pH 10; Zazzabi: 25 °C (1) ACD
logP -0.363±0.611 Zazzabi: 25 °C (1) ACD
Rawanin Jiki na Yaro 1.6g/L Zazzabi: 25°C (1) ACD
Mass Solubility 504 g/L pH 1; Zazzabi: 25 °C (1) ACD
Mass Solubility 409 g/L pH 2; Zazzabi: 25 °C (1) ACD
Mass Solubility 140 g/L pH 3; Zazzabi: 25 °C (1) ACD
Mass Solubility 20 g/L pH 4; Zazzabi: 25 °C (1) ACD
Mass Solubility 3.6 g/L pH 5; Zazzabi: 25 °C (1) ACD
Mass Solubility 1.8 g/L pH 6; Zazzabi: 25 °C (1) ACD
Mass Solubility 1.7 g/L pH 7; Zazzabi: 25 °C (1) ACD
Mass Solubility 1.6 g/L pH 8; Zazzabi: 25 °C (1) ACD
Mass Solubility 1.6 g/L pH 9; Zazzabi: 25 °C (1) ACD
Mass Solubility 1.6 g/L pH 10; Zazzabi: 25 °C (1) ACD

(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Yawan yawa

Dukiya Daraja Yanayi Source
Yawan yawa 1.98± 0.1 g/cm3 Zazzabi: 20 ° C; Latsa: 760 Torr (1) ACD
Ƙarar Molar 149.3 ± 7.0 cm3/mol Zazzabi: 20 ° C; Latsa: 760 Torr (1) ACD

(1) An ƙididdige ta ta amfani da Ci gaban Chemistry na Babba (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Lipinski

Dukiya Daraja Yanayi Source
Ƙimar Rarraba Kyauta 5   (1) ACD
H Masu karɓa 10   (1) ACD
H Masu Ba da taimako 6   (1) ACD
H Donor/Acceptor Sum 16   (1) ACD
logP -0.363± 0.611 Zazzabi: 25 ° C (1) ACD
Nauyin Kwayoyin Halitta 296.28    

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