C9H10N2O5 6H-FURO [2 ′, 3 ′: 4,5] oxazolo [3,2-a] pyrimidin-6-moja, 2,3,3a, 9a-tetrah ydro-3-hydroxy-2- (hydroxymelyl)-, (2r, 3 r, 9ar)-(9c)-(9c)-(9C) (9, 3AS)-9AR) (9, 3AS)-9AR)-9AR.
Nambari ya Usajili wa CAS
3736-77-4
Sifa muhimu za mwili | Thamani | Hali |
Uzito wa Masi | 226.19 | - |
Hatua ya kuyeyuka (majaribio) | 234-235 ° C. | - |
Kiwango cha kuchemsha (kilitabiriwa) | 456.3 ± 55.0 ° C. | Bonyeza: 760 Torr |
Uzani (uliotabiriwa) | 2.01 ± 0.1 g/cm3 | Temp: 20 ° C; Bonyeza: 760 Torr |
PKA (alitabiri) | 12.55 ± 0.40 | Templeti nyingi za asidi: 25 ° C. |
Tabasamu za Canonical
O = C1N = C2OC3C (O) C (OC3N2C = C1) CO
Tabasamu za Isomeric
O [c@h] 1 [c@] 2 ([c@] (n3c (o2) = nc (= o) c = c3) (o [c @@ h] 1co) [h]) [h]
Inchi
Inchi = 1S/C9H10N2O5/C12-3-4-6 (14) 7-8 (15-4) 11-2-1-5 (13) 10-9 (11) 16-7/H1-2,4,6-8,12,14h, 3h2/t4-, 6-, 7+, 8-/m1/s1
Ufunguo wa Inchi
UUGITDASWNOAGG-CCXZUQQUSA-N
Majina mengine 13 kwa dutu hii
. 6H-Furo [2 ′, 3 ′: 4,5] oxazolo [3,2-a] pyrimidin-6-moja, 2,3,3a, 9a-tetrahydro-3-hydroxy-2- (hydroxymethyl)-(6ci, 7ci); 6H-Furo [2 ′, 3 ′: 4,5] oxazolo [3,2-a] pyrimidin-6-moja, 2,3,3a, 9a-tetrahydro-3-hydroxy-2- (hydroxymethyl)-, [2r- (2α, 3β, 3Aβ)-(Zc)); 6H-Furo [2 ′, 3 ′: 4,5] oxazolo [3,2-a]
pyrimidin-6-moja, 2,3,3a, 9a-tetrahydro-3-hydroxy-2- (hydroxymethyl)-, stereoisomer (8ci); 2,2 ′ -anhydro (1- β -d -arabinofuranosyl) uracil; 2,2 ′ -anhydro-1- β -D-Arabino-Furanosyluracil; 2,2 ′ -anhydro-n1- (β -d-arabinofuranosyl) uracil; 2,2 ′ -anhydrouridine; 2,2 ′ -O -cyclouridine; NSC 157148; O2,2 ′ -anhydrouridine; O2,2 ′ -cyclouridine; β -D-2 ′, 2-O-cycloarabinouridine
Mali inapatikana
Macho na kutawanya
Mafuta
Mali | Thamani | Hali | Chanzo |
Nguvu ya mzunguko wa macho | -19 deg | Kutengenezea: methanoli; λ: 589.3 nm; Temp: 26 ° c | (1) CAS |
(1) Codington, John F.; Jarida la Jumuiya ya Kemikali ya Amerika, (1961), 83, 5030-1, Caplus
Mali | Thamani | Hali | Chanzo |
Hatua ya kuyeyuka | 250-253 ° C. | (1) CAS | |
Hatua ya kuyeyuka | 246 ° C. | Kutengenezea: ethanol; Isopropanol | (2) CAS |
Hatua ya kuyeyuka | 242-245 ° C. | (3) CAS | |
Hatua ya kuyeyuka | 242-243 ° C. | (4) CAS | |
Hatua ya kuyeyuka | 236-238 ° C (DECOMP) | (5) CAS | |
Hatua ya kuyeyuka | 234 ° C. | (6) CAS | |
Hatua ya kuyeyuka | 234-235 ° C. | (7) CAS | |
Hatua ya kuyeyuka | 233-234 ° C (kutengana) | Kutengenezea: methanoli | (8) CAS |
Hatua ya kuyeyuka | Tazama maandishi kamili | (9) CAS |
(1) Lin, Kun-I.; Jarida la Jumuiya ya Kemikali ya China (Taipei, Taiwan), (2007), 54 (2), 563-568, Caplus
(2) Takatsuki, Ken-Ichi; Nucleosides, Nucleotides & Asidi ya Nyuklia, (2006), 25 (7), 719-734, Caplus
(3) Wnuk, Stanislaw F.; Jarida la Kemia ya Kikaboni, (2002), 67 (6), 1816-1819, Caplus
(4) Szlenkier, Maurycy; Nucleosides, Nucleotides & Acids ya Nyuklia, (2016), 35 (8), 410-425, Caplus
(5) Marumoto, Ryuji; Takeda Kenkyusho Nenpo, (1967), 26, 21-3, Caplus
(6) Krizmanic, Irena; Tetrahedron, (2003), 59 (23), 4047-4057, Caplus
(7) Brown, DM; Jarida la Jumuiya ya Kemikali, (1958), 3035-8, Caplus
(8) li, heting; Mawasiliano ya Syntetisk, (2006), 36 (14), 1933-1940, Caplus
(9) Codington, John F.; Jarida la Jumuiya ya Kemikali ya Amerika, (1961), 83, 5030-1, Caplus
Spectra inapatikana
1 H NMR
13 C NMR
IR
Spectra inapatikana
Misa
Mali inapatikana
Kibaolojia
Kemikali
Wiani
Lipinski
Muundo unaohusiana
Mafuta
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 |
.
Mali | Thamani | Hali | Chanzo |
KOC | 7.66 | pH 1; Temp: 25 ° c | (1) ACD |
KOC | 7.66 | pH 2; Temp: 25 ° c | (1) ACD |
KOC | 7.66 | pH 3; Temp: 25 ° c | (1) ACD |
KOC | 7.66 | pH 4; Temp: 25 ° c | (1) ACD |
KOC | 7.66 | pH 5; Temp: 25 ° c | (1) ACD |
KOC | 7.66 | pH 6; Temp: 25 ° c | (1) ACD |
KOC | 7.66 | pH 7; Temp: 25 ° c | (1) ACD |
KOC | 7.66 | pH 8; Temp: 25 ° c | (1) ACD |
Mali | Thamani | Hali | Chanzo |
KOC | 7.66 | pH 9; Temp: 25 ° c | (1) ACD |
KOC | 7.64 | pH 10; Temp: 25 ° c | (1) ACD |
logi | -0.91 | pH 1; Temp: 25 ° c | (1) ACD |
logi | -0.91 | pH 2; Temp: 25 ° c | (1) ACD |
logi | -0.91 | pH 3; Temp: 25 ° c | (1) ACD |
logi | -0.91 | pH 4; Temp: 25 ° c | (1) ACD |
logi | -0.91 | pH 5; Temp: 25 ° c | (1) ACD |
logi | -0.91 | pH 6; Temp: 25 ° c | (1) ACD |
logi | -0.91 | pH 7; Temp: 25 ° c | (1) ACD |
logi | -0.91 | pH 8; Temp: 25 ° c | (1) ACD |
logi | -0.91 | pH 9; Temp: 25 ° c | (1) ACD |
logi | -0.91 | pH 10; Temp: 25 ° c | (1) ACD |
Logp | -0.906 ± 0.555 | Temp: 25 ° c | (1) ACD |
Umumunyifu wa ndani | 4.7 g/l | Temp: 25 ° c | (1) ACD |
Umumunyifu wa wingi | 4.7 g/l | pH 1; Temp: 25 ° c | (1) ACD |
Umumunyifu wa wingi | 4.7 g/l | pH 2; Temp: 25 ° c | (1) ACD |
Umumunyifu wa wingi | 4.7 g/l | pH 3; Temp: 25 ° c | (1) ACD |
Umumunyifu wa wingi | 4.7 g/l | pH 4; Temp: 25 ° c | (1) ACD |
Umumunyifu wa wingi | 4.7 g/l | pH 5; Temp: 25 ° c | (1) ACD |
Umumunyifu wa wingi | 4.7 g/l | pH 6; Temp: 25 ° c | (1) ACD |
Umumunyifu wa wingi | 4.7 g/l | pH 7; Temp: 25 ° c | (1) ACD |
Umumunyifu wa wingi | 4.7 g/l | pH 8; Temp: 25 ° c | (1) ACD |
Umumunyifu wa wingi | 4.7 g/l | pH 9; Temp: 25 ° c | (1) ACD |
Umumunyifu wa wingi | 4.7 g/l | pH 10; Temp: 25 ° c | (1) ACD |
Umumunyifu wa wingi | 4.7 g/l | Maji yasiyokuwa na maji pH 6.91; Temp: 25 ° c | (1) ACD |
Umumunyifu wa ndani wa molar | 0.021 mol/L. | Temp: 25 ° c | (1) ACD |
Umumunyifu wa molar | 0.021 mol/L. | pH 1; Temp: 25 ° c | (1) ACD |
Umumunyifu wa molar | 0.021 mol/L. | pH 2; Temp: 25 ° c | (1) ACD |
Umumunyifu wa molar | 0.021 mol/L. | pH 3; Temp: 25 ° c | (1) ACD |
Umumunyifu wa molar | 0.021 mol/L. | pH 4; Temp: 25 ° c | (1) ACD |
Umumunyifu wa molar | 0.021 mol/L. | pH 5; Temp: 25 ° c | (1) ACD |
Umumunyifu wa molar | 0.021 mol/L. | pH 6; Temp: 25 ° c | (1) ACD |
Mali | Thamani | Hali | Chanzo |
Umumunyifu wa molar | 0.021 mol/L. | pH 7; Temp: 25 ° c | (1) ACD |
Umumunyifu wa molar | 0.021 mol/L. | pH 8; Temp: 25 ° c | (1) ACD |
Umumunyifu wa molar | 0.021 mol/L. | pH 9; Temp: 25 ° c | (1) ACD |
Umumunyifu wa molar | 0.021 mol/L. | pH 10; Temp: 25 ° c | (1) ACD |
Umumunyifu wa molar | 0.021 mol/L. | Maji yasiyokuwa na maji pH 6.91; Temp: 25 ° c | (1) ACD |
Uzito wa Masi | 226.19 | ||
PKA | 12.55 ± 0.40 | Templeti nyingi za asidi: 25 ° C. | (1) ACD |
PKA | -4.68 ± 0.60 | Muda wa msingi zaidi: 25 ° C. | (1) ACD |
Shinikizo la mvuke | 3.04 x 10-10 Torr | Temp: 25 ° c | (1) ACD |
.
Mali | Thamani | Hali | Chanzo |
Wiani | 2.01 ± 0.1 g/cm3 | Temp: 20 ° C; Bonyeza: 760 Torr | (1) ACD |
Kiasi cha molar | 112.3 ± 7.0 cm3/mol | Temp: 20 ° C; Bonyeza: 760 Torr | (1) ACD |
.
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 | -0.906 ± 0.555 | Temp: 25 ° c | (1) ACD |
Uzito wa Masi | 226.19 |
.
Mali | Thamani | Chanzo cha hali |
Eneo la uso wa polar | 91.6 A2 | (1) ACD |
.
Mali | Thamani | Hali | Chanzo |
Kiwango cha kuchemsha | 456.3 ± 55.0 ° C. | Bonyeza: 760 Torr | (1) ACD |
Mali | Thamani | Hali | Chanzo |
Enthalpy ya mvuke | 82.62 ± 6.0 kJ/mol | Bonyeza: 760 Torr | (1) ACD |
Kiwango cha Flash | 229.8 ± 31.5 ° C. | (1) ACD |
.
Spectra inapatikana
1 H NMR
13 C NMR
Chanzo cha Taarifa ya Hatari ya Msimbo | |
H302 inadhuru ikiwa imemezwa | Uainishaji wa Wakala wa Kemikali wa Ulaya (ECHA) na uandishi Uainishaji - Uainishaji ulioarifiwa na Uandishi - Arifa za Kawaida, Wakala wa Kemikali wa Ulaya (ECHA) Uainishaji na Uainishaji wa Uainishaji - Uainishaji ulioarifiwa na Uandishi - Arifa kubwa zaidi |