C10H12N2O5 6H-FURO [2 ′, 3 ′: 4,5] oxazolo [3,2-a] pyrimidin-6-moja, 2,3,3a, 9a-tetrah ydro-3-hydroxy-2- (hydroxymethyl) -7-methyl-, (2r, 3, 3, 3, 3, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3

Bidhaa

C10H12N2O5 6H-FURO [2 ′, 3 ′: 4,5] oxazolo [3,2-a] pyrimidin-6-moja, 2,3,3a, 9a-tetrah ydro-3-hydroxy-2- (hydroxymethyl) -7-methyl-, (2r, 3, 3, 3, 3, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3, 3 r, 3

Habari ya kimsingi:


Maelezo ya bidhaa

Vitambulisho vya bidhaa

Maelezo ya dutu

Nambari ya Usajili wa CAS

22423-26-3

Sifa muhimu za mwili Thamani Hali
Uzito wa Masi 240.21 -
Hatua ya kuyeyuka (majaribio) 218 ° C. Kutengenezea: ethanol; Isopropanol
Kiwango cha kuchemsha (kilitabiriwa) 452.0 ± 55.0 ° C. Bonyeza: 760 Torr
Uzani (uliotabiriwa) 1.88 ± 0.1 g/cm3 Temp: 20 ° C; Bonyeza: 760 Torr
PKA (alitabiri) 12.56 ± 0.60 Templeti nyingi za asidi: 25 ° C.

Majina mengine na vitambulisho

Tabasamu za Canonical

O = C1N = C2OC3C (O) C (OC3N2C = C1C) CO

Tabasamu za Isomeric

O [c@h] 1 [c@] 2 ([c@] (n3c (o2) = nc (= o) c (c) = c3) (o [c @@ h] 1co) [h]) [h]

Inchi

Inchi = 1S/C10H12N2O5/C1-4-2-12-9-7 (6 (14) 5 (3-13) 16-9) 17-10 (12) 11-8 (4) 15/H2,5-7,9,13-14H, 3H2,1H3/T5-, 6-, 7+, 9-/S1

Ufunguo wa Inchi

Wlloaucnumyoqi-jagxhnfqsa-n

Majina mengine 17 kwa dutu hii

(2R,3 R, 3aS, 9aR) -2,3,3a, 9a-tetrahydro-3-hydroxy-2- (hydroxymethyl) -7-methyl-6H-Furo [2 ′, 3 ′: 4,5] oxazolo [3,2-a] pyrimidin-6-moja (ACI);

6H-Furo [2 ′, 3 ′: 4,5] oxazolo [3,2-a] pyrimidin-6-moja, 2,3,3a, 9a-tetrahydro-3-hydroxy-2- (hydroxymethyl) -7-methyl- (6ci, 7ci, 8ci); 6.H-Furo

[2 ′, 3 ′: 4,5] oxazolo [3,2-a] pyrimidin-6-moja, 2,3,3a, 9a-tetrahydro-3-hydroxy-2- (hydroxymethyl) -7-methyl-, [2R- (2α, 3β, 3aβ, 9aβ)]- (ZCI);

11: PN: US20040014699 Ukurasa: 18 ilidai DNA; 12: PN: US20040005565 Ukurasa: 17- 22 Alidai DNA; 12: PN: US20040005570 Ukurasa: 18 madai ya DNA; 12: PN: US20040006029 Ukurasa: 21 ilidai DNA; 12: PN: US20040014051 Ukurasa: 21 madai ya DNA; 1: PN: WO20050 06958 Ukurasa: 59 alidai DNA; 2,2 ′ -anhydro (1- β -d-arabinofuranosyl)-5-methyluracil; 3: PN: WO2005007825 Ukurasa: 59 alidai DNA; 84: PN: US20040005707 Ukurasa: 18 ilidai DNA; 9: PN: US20040014048 Ukurasa: 19 alidai DNA; 9: PN: US20040014049 Ukurasa: 19

madai ya DNA;O2,2 ′ -anhydro-5-methyluridine; O2,2 ′ -anhydro-5-methyluridine; Tk 112690

Mali ya majaribio

Mali inapatikana
Mafuta

Mafuta

Mali Thamani Hali Chanzo
Hatua ya kuyeyuka 240-242 ° C. (1) CAS
Hatua ya kuyeyuka 218 ° C. Kutengenezea: ethanol; Isopropanol (2) CAS
Hatua ya kuyeyuka Tazama maandishi kamili (3) CAS
Hatua ya kuyeyuka Tazama maandishi kamili (4) CAS

(1) Oliveira, Maralise P.; Jarida la Jumuiya ya Kemikali ya Brazil, (2015), 26 (4), 816-821, Caplus

(2) Takatsuki, Ken-Ichi; Nucleosides, Nucleotides & Asidi ya Nyuklia, (2006), 25 (7), 719-734, Caplus

(3) Manoharan, Muthiah; US20030088079, A1, 2003, Caplus

(4) Miraglia, Loren J.; WO2003048315, A2, 2003, Caplus

Majaribio ya majaribio

Spectra inayopatikana
1 H NMR
13 C NMR
Hetero nmr
Misa

Mali zilizotabiriwa

Mali inapatikana
Kibaolojia
Kemikali
Wiani
Lipinski
Muundo unaohusiana
Mafuta

Kibaolojia

Mali Thamani Hali Chanzo
Sababu ya bioconcentration 1.0 pH 1; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 1.0 pH 2; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 1.0 pH 3; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 1.0 pH 4; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 1.0 pH 5; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 1.0 pH 6; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 1.0 pH 7; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 1.0 pH 8; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 1.0 pH 9; Temp: 25 ° c (1) ACD
Sababu ya bioconcentration 1.0 pH 10; Temp: 25 ° c (1) ACD

.

Kemikali

Mali Thamani Hali Chanzo
KOC 12.9 pH 1; Temp: 25 ° c (1) ACD
KOC 12.9 pH 2; Temp: 25 ° c (1) ACD
KOC 12.9 pH 3; Temp: 25 ° c (1) ACD
KOC 12.9 pH 4; Temp: 25 ° c (1) ACD
KOC 12.9 pH 5; Temp: 25 ° c (1) ACD
KOC 12.9 pH 6; Temp: 25 ° c (1) ACD
KOC 12.9 pH 7; Temp: 25 ° c (1) ACD
KOC 12.9 pH 8; Temp: 25 ° c (1) ACD
KOC 12.9 pH 9; Temp: 25 ° c (1) ACD
KOC 12.9 pH 10; Temp: 25 ° c (1) ACD
logi -0.49 pH 1; Temp: 25 ° c (1) ACD
logi -0.49 pH 2; Temp: 25 ° c (1) ACD
logi -0.49 pH 3; Temp: 25 ° c (1) ACD
logi -0.49 pH 4; Temp: 25 ° c (1) ACD
logi -0.49 pH 5; Temp: 25 ° c (1) ACD
logi -0.49 pH 6; Temp: 25 ° c (1) ACD
logi -0.49 pH 7; Temp: 25 ° c (1) ACD
logi -0.49 pH 8; Temp: 25 ° c (1) ACD
logi -0.49 pH 9; Temp: 25 ° c (1) ACD
logi -0.49 pH 10; Temp: 25 ° c (1) ACD

 

Mali Thamani Hali Chanzo
Logp -0.491 ± 0.556 Temp: 25 ° c (1) ACD
Umumunyifu wa ndani 3.1 g/l Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 3.1 g/l pH 1; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 3.1 g/l pH 2; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 3.1 g/l pH 3; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 3.1 g/l pH 4; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 3.1 g/l pH 5; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 3.1 g/l pH 6; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 3.1 g/l pH 7; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 3.1 g/l pH 8; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 3.1 g/l pH 9; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 3.1 g/l pH 10; Temp: 25 ° c (1) ACD
Umumunyifu wa wingi 3.1 g/l Maji yasiyokuwa na maji pH 6.94; Temp: 25 ° c (1) ACD
Umumunyifu wa ndani wa molar 0.013 mol/L. Temp: 25 ° c (1) ACD
Umumunyifu wa molar 0.013 mol/L. pH 1; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 0.013 mol/L. pH 2; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 0.013 mol/L. pH 3; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 0.013 mol/L. pH 4; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 0.013 mol/L. pH 5; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 0.013 mol/L. pH 6; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 0.013 mol/L. pH 7; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 0.013 mol/L. pH 8; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 0.013 mol/L. pH 9; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 0.013 mol/L. pH 10; Temp: 25 ° c (1) ACD
Umumunyifu wa molar 0.013 mol/L. Maji yasiyokuwa na maji pH 6.94; Temp: 25 ° c (1) ACD
Uzito wa Masi 240.21    
PKA 12.56 ± 0.60 Templeti nyingi za asidi: 25 ° C. (1) ACD
PKA -4.36 ± 0.60 Muda wa msingi zaidi: 25 ° C. (1) ACD
Shinikizo la mvuke 4.54 x 10-10 Torr Temp: 25 ° c (1) ACD

.

Mali Thamani Hali Chanzo
Wiani 1.88 ± 0.1 g/cm3 Temp: 20 ° C; Bonyeza: 760 Torr (1) ACD
Kiasi cha molar 127.5 ± 7.0 cm3/mol Temp: 20 ° C; Bonyeza: 760 Torr (1) ACD

.

Lipinski

Mali Thamani Hali Chanzo
Vifungo vya mzunguko wa bure 3   (1) ACD
Wapokeaji 7   (1) ACD
H wafadhili 2   (1) ACD
H wafadhili/jumla ya jumla 9   (1) ACD
Logp -0.491 ± 0.556 Temp: 25 ° c (1) ACD
Uzito wa Masi 240.21    

.

Muundo unaohusiana

Mali Thamani Chanzo cha hali
Eneo la uso wa polar 91.6 A2 (1) ACD

.

Mafuta

Mali Thamani Hali Chanzo
Kiwango cha kuchemsha 452.0 ± 55.0 ° C. Bonyeza: 760 Torr (1) ACD
Enthalpy ya mvuke 82.04 ± 6.0 kJ/mol Bonyeza: 760 Torr (1) ACD
Kiwango cha Flash 227.2 ± 31.5 ° C.   (1) ACD

.

Utabiri uliotabiriwa

Spectra inapatikana ⁿ
1 H NMR
13 C NMR


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