![C9H10N2O5 6H-Furo[2′,3′:4,5]oxazolo[3,2-a]pyrimidin-6-ọkan, 2,3,3a,9a-tetrah ydro-3-hydroxy-2-(hydroxymethyl) , (2R,3 R,3aS,9aR)- (9CI, ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C9H10N2O5 6H-Furo[2′,3′:4,5]oxazolo[3,2-a]pyrimidin-6-ọkan, 2,3,3a,9a-tetrah ydro-3-hydroxy-2-(hydroxymethyl) , (2R,3 R,3aS,9aR)- (9CI, ACI) Aworan Afihan](https://cdn.globalso.com/nvchem/C9H10N2O5-6H-Furo.png)
C9H10N2O5 6H-Furo[2′,3′:4,5]oxazolo[3,2-a]pyrimidin-6-ọkan, 2,3,3a,9a-tetrah ydro-3-hydroxy-2-(hydroxymethyl) , (2R,3 R,3aS,9aR)- (9CI, ACI)
Nọmba iforukọsilẹ CAS
3736-77-4
| Key Properties Properties | Iye | Ipo |
| Òṣuwọn Molikula | 226.19 | - |
| Ibi Iyọ (Ayẹwo) | 234-235 °C | - |
| Oju Ise (Asọtẹlẹ) | 456,3 ± 55,0 °C | Tẹ: 760 Torr |
| iwuwo (Asọtẹlẹ) | 2,01 ± 0,1 g / cm3 | Iwọn otutu: 20 °C; Tẹ: 760 Torr |
| pKa (Asọtẹlẹ) | 12.55 ± 0.40 | Pupọ Epo otutu: 25 °C |
Ẹ̀RẸ̀ KẸ̀LẸ̀
O=C1N=C2OC3C(O)C(OC3N2C=C1)CO
ISOMERIC SMILES
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
InChi Key
UUGITDASWNOAGG-CCXZUQQUSA-N
13 Awọn orukọ miiran fun nkan yii
(2R,3 R,3aS,9aR) -2,3,3a,9a-Tetrahydro-3-hydroxy-2- (hydroxymethyl) -6H-furo[2′,3′:4,5]oxazolo[3,2] -a] pyrimidin-6-ọkan (ACI); 6H-Furo [2′, 3′:4,5]oxazolo [3,2-a] pyrimidin-6-one, 2,3,3a,9a-tetrahydro-3-hydroxy-2- (hydroxymethyl) - (6CI) , 7CI); 6H-Furo [2′,3′:4,5]oxazolo [3,2-a] pyrimidin-6-one, 2,3,3a,9a-tetrahydro-3-hydroxy-2- (hydroxymethyl) -, [ 2R- (2α,3β,3aβ,9aβ)]- (ZCI); 6H-Furo[2′,3′:4,5]oxazolo[3,2-a]
pyrimidin-6-ọkan, 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
Awọn ohun-ini ti o wa
Opitika ati tuka
Gbona
| Ohun ini | Iye | Ipo | Orisun |
| Opitika Yiyi Power | -19 iwọn | Ohun elo: kẹmika; λ: 589.3 nm; Iwọn otutu: 26 °C | (1) CAS |
(1) Codington, John F.; Iwe akosile ti American Chemical Society, (1961), 83, 5030-1, CAplus
| Ohun ini | Iye | Ipo | Orisun |
| Ojuami Iyo | 250-253 °C | (1) CAS | |
| Ojuami Iyo | 246 °C | Ohun elo: Ethanol; Isopropanol | (2) CAS |
| Ojuami Iyo | 242-245 °C | (3) CAS | |
| Ojuami Iyo | 242-243 °C | (4) CAS | |
| Ojuami Iyo | 236-238 °C (decomp) | (5) CAS | |
| Ojuami Iyo | 234 °C | (6) CAS | |
| Ojuami Iyo | 234-235 °C | (7) CAS | |
| Ojuami Iyo | 233-234°C (decomp) | Ohun elo: kẹmika | (8) CAS |
| Ojuami Iyo | Wo Ẹkunrẹrẹ Ọrọ | (9) CAS |
(1) Lin, Kun-I.; Iwe akosile ti Awujọ Kemikali Kannada (Taipei, Taiwan), (2007), 54 (2), 563-568, CAplus
(2) Takatsuki, Ken-ichi; Nucleosides, Nucleotides & Nucleic Acids, (2006), 25(7), 719-734, CAplus
(3) Wnuk, Stanislaw F.; Iwe akosile ti Kemistri Organic, (2002), 67 (6), 1816-1819, CAplus
(4) Szlenkier, Maurycy; Nucleosides, Nucleotides & Nucleic Acids, (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; Iwe akosile ti Awujọ Kemikali, (1958), 3035-8, CAplus
(8) Li, Heting; Awọn ibaraẹnisọrọ sintetiki, (2006), 36 (14), 1933-1940, CAplus
(9) Codington, John F.; Iwe akosile ti American Chemical Society, (1961), 83, 5030-1, CAplus
Spectra wa
1 H NMR
13 C NMR
IR
Spectra wa
Ibi
Awọn ohun-ini ti o wa
Ti ibi
Kemikali
iwuwo
Lipinski
Ilana Jẹmọ
Gbona
| Ohun ini | Iye | Ipo | Orisun |
| Bioconcentration ifosiwewe | 1.0 | pH 1; Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 1.0 | pH 2; Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 1.0 | pH 3; Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 1.0 | pH 4; Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 1.0 | pH 5; Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 1.0 | pH 6; Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 1.0 | pH 7; Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 1.0 | pH 8; Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 1.0 | pH 9; Iwọn otutu: 25 °C | (1) ACD |
| Bioconcentration ifosiwewe | 1.0 | pH 10; Iwọn otutu: 25 °C | (1) ACD |
(1) Iṣiro nipa lilo Idagbasoke Kemistri To ti ni ilọsiwaju (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Ohun ini | Iye | Ipo | Orisun |
| Koc | 7.66 | pH 1; Iwọn otutu: 25 °C | (1) ACD |
| Koc | 7.66 | pH 2; Iwọn otutu: 25 °C | (1) ACD |
| Koc | 7.66 | pH 3; Iwọn otutu: 25 °C | (1) ACD |
| Koc | 7.66 | pH 4; Iwọn otutu: 25 °C | (1) ACD |
| Koc | 7.66 | pH 5; Iwọn otutu: 25 °C | (1) ACD |
| Koc | 7.66 | pH 6; Iwọn otutu: 25 °C | (1) ACD |
| Koc | 7.66 | pH 7; Iwọn otutu: 25 °C | (1) ACD |
| Koc | 7.66 | pH 8; Iwọn otutu: 25 °C | (1) ACD |
| Ohun ini | Iye | Ipo | Orisun |
| Koc | 7.66 | pH 9; Iwọn otutu: 25 °C | (1) ACD |
| Koc | 7.64 | pH 10; Iwọn otutu: 25 °C | (1) ACD |
| logD | -0.91 | pH 1; Iwọn otutu: 25 °C | (1) ACD |
| logD | -0.91 | pH 2; Iwọn otutu: 25 °C | (1) ACD |
| logD | -0.91 | pH 3; Iwọn otutu: 25 °C | (1) ACD |
| logD | -0.91 | pH 4; Iwọn otutu: 25 °C | (1) ACD |
| logD | -0.91 | pH 5; Iwọn otutu: 25 °C | (1) ACD |
| logD | -0.91 | pH 6; Iwọn otutu: 25 °C | (1) ACD |
| logD | -0.91 | pH 7; Iwọn otutu: 25 °C | (1) ACD |
| logD | -0.91 | pH 8; Iwọn otutu: 25 °C | (1) ACD |
| logD | -0.91 | pH 9; Iwọn otutu: 25 °C | (1) ACD |
| logD | -0.91 | pH 10; Iwọn otutu: 25 °C | (1) ACD |
| logP | -0.906 ± 0.555 | Iwọn otutu: 25 °C | (1) ACD |
| Ibi Isolubu Agbekale | 4.7 g/L | Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 4.7 g/L | pH 1; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 4.7 g/L | pH 2; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 4.7 g/L | pH 3; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 4.7 g/L | pH 4; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 4.7 g/L | pH 5; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 4.7 g/L | pH 6; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 4.7 g/L | pH 7; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 4.7 g/L | pH 8; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 4.7 g/L | pH 9; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 4.7 g/L | pH 10; Iwọn otutu: 25 °C | (1) ACD |
| Ibi Solubility | 4.7 g/L | Omi ti a ko fi silẹ pH 6.91; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Inu inu Molar | 0.021 mol/L | Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 0.021 mol/L | pH 1; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 0.021 mol/L | pH 2; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 0.021 mol/L | pH 3; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 0.021 mol/L | pH 4; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 0.021 mol/L | pH 5; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 0.021 mol/L | pH 6; Iwọn otutu: 25 °C | (1) ACD |
| Ohun ini | Iye | Ipo | Orisun |
| Solubility Molar | 0.021 mol/L | pH 7; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 0.021 mol/L | pH 8; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 0.021 mol/L | pH 9; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 0.021 mol/L | pH 10; Iwọn otutu: 25 °C | (1) ACD |
| Solubility Molar | 0.021 mol/L | Omi ti a ko fi silẹ pH 6.91; Iwọn otutu: 25 °C | (1) ACD |
| Òṣuwọn Molikula | 226.19 | ||
| pKa | 12.55 ± 0.40 | Pupọ Epo otutu: 25 °C | (1) ACD |
| pKa | -4,68 ± 0,60 | Pupọ Ipilẹ otutu: 25 °C | (1) ACD |
| Oru Ipa | 3.04 x 10-10 Torr | Iwọn otutu: 25 °C | (1) ACD |
(1) Iṣiro nipa lilo Idagbasoke Kemistri To ti ni ilọsiwaju (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Ohun ini | Iye | Ipo | Orisun |
| iwuwo | 2,01 ± 0,1 g / cm3 | Iwọn otutu: 20 °C; Tẹ: 760 Torr | (1) ACD |
| Iwọn didun Molar | 112,3 ± 7,0 cm3 / mol | Iwọn otutu: 20 °C; Tẹ: 760 Torr | (1) ACD |
(1) Iṣiro nipa lilo Idagbasoke Kemistri To ti ni ilọsiwaju (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Ohun ini | Iye | Ipo | Orisun |
| Larọwọto Rotatable Bonds | 3 | (1) ACD | |
| H Awọn olugba | 7 | (1) ACD | |
| H Awọn oluranlọwọ | 2 | (1) ACD | |
| H Oluranlọwọ / Olugba Apapọ | 9 | (1) ACD | |
| logP | -0.906 ± 0.555 | Iwọn otutu: 25 °C | (1) ACD |
| Òṣuwọn Molikula | 226.19 |
(1) Iṣiro nipa lilo Idagbasoke Kemistri To ti ni ilọsiwaju (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Ohun ini | Iye | Orisun ipo |
| Pola dada Area | 91.6 A2 | (1) ACD |
(1) Iṣiro nipa lilo Idagbasoke Kemistri To ti ni ilọsiwaju (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
| Ohun ini | Iye | Ipo | Orisun |
| Ojuami farabale | 456,3 ± 55,0 °C | Tẹ: 760 Torr | (1) ACD |
| Ohun ini | Iye | Ipo | Orisun |
| Enthalpy ti Vaporization | 82,62 ± 6,0 kJ / mol | Tẹ: 760 Torr | (1) ACD |
| Oju filaṣi | 229,8 ± 31,5 °C | (1) ACD |
(1) Iṣiro nipa lilo Idagbasoke Kemistri To ti ni ilọsiwaju (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)
Spectra wa
1 H NMR
13 C NMR
| Orisun Gbólóhùn Ewu koodu | |
| H302 Ipalara ti o ba gbe | Ile-iṣẹ Kemikali ti Yuroopu (ECHA) Isọdi& Aami aami Oja - Isọdi iwifunni ati isamisi - awọn iwifunni ti o wọpọ julọ, Ile-iṣẹ Kemikali Yuroopu (ECHA) Isọsọ-sọtọ&Oja Ifipamọ - Isọdi ti iwifunni ati isamisi - awọn iwifunni to ṣe pataki julọ |
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