C9H11FN2O5 Uridine, 2′ -deoxy-2′ -fluoro- (7CI, 8CI, 9CI, ACI)

ọja

C9H11FN2O5 Uridine, 2′ -deoxy-2′ -fluoro- (7CI, 8CI, 9CI, ACI)

Alaye ipilẹ:


Alaye ọja

ọja Tags

Awọn alaye nkan elo

Nọmba iforukọsilẹ CAS

784-71-4

H228

Key Properties Properties Iye Ipo
Òṣuwọn Molikula 246.19 -
Ibi Iyọ (Ayẹwo) 149-150 °C -
iwuwo (Asọtẹlẹ) 1,63 ± 0,1 g / cm3 Iwọn otutu: 20 °C; Tẹ: 760 Torr
pKa (Asọtẹlẹ) 9.39 ± 0.10 Pupọ Epo otutu: 25 °C

Miiran awọn orukọ ati idamo

Ẹ̀RẸ̀ KẸ̀LẸ̀

O=C1C=CN(C(=O)N1)C2OC(CO)C(O)C2F

ISOMERIC SMILES

F[C@H]1[C@@H](O[C@H](CO)[C@H]1O)N2C(=O)NC(=O)C=C2

InChi

InChi = 1S/C9H11FN2O5/c10-6-7(15)4(3-13)17-8(6)12-2-1-5(14)11-9(12)16/h1-2,4, 6-8,13,15H,3H2,(H,11,14,16)/t4-,6-,7-,8-/m1/s1

InChi Key

UIYWFOZZIZEEKJ-XVFCMESISA-N

4 Awọn orukọ miiran fun nkan yii

2 "-Deoxy-2" -fluorouridine (ACI); 1- (2-Deoxy-2-fluoro- β -D-ribofuranosyl) uracil; 2 "-Fluoro-2" -deoxyuridine; 2′-Fluoro-uridine

Awọn ohun-ini ti o wa
Opitika ati tuka
Gbona

Opitika ati Scatering

Ohun ini Iye Ipo Orisun
Opitika Yiyi Power + 52 iwọn Omi: Omi; λ: 589.3 nm; Iwọn otutu: 20 °C (1) CAS

(1) Codington, John F.; Iwe akosile ti American Chemical Society, (1961), 83, 5030-1, CAplus

Gbona

Ohun ini Iye Orisun ipo
Ojuami Iyo 149-150 °C (1) IC
Ojuami Iyo Wo Ẹkunrẹrẹ Ọrọ (2) CAS
Ojuami Iyo Wo Ẹkunrẹrẹ Ọrọ (3) IC

(1) Mercer, John R.; Iwe akosile ti Kemistri Oogun, (1989), 32 (6), 1289-94, CAplus

(2) Codington, John F.; Iwe akosile ti American Chemical Society, (1961), 83, 5030-1, CAplus

(3) Van Aerschot, A.; Bulletin des Societes Chimiques Belges, (1989), 98 (12), 937-41, CAplus

Sipekitira esiperimenta

Spectra wa
1 H NMR
13 C NMR
Hetero NMR
IR
Ibi
Ramani
UV ati Wiwa

Awọn ohun-ini asọtẹlẹ

Awọn ohun-ini ti o wa
Ti ibi
Kemikali
iwuwo
Lipinski
Ilana Jẹmọ

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)

Kemikali

Ohun ini Iye Ipo Orisun
Koc 12.1 pH 1; Iwọn otutu: 25 °C (1) ACD
Koc 12.1 pH 2; Iwọn otutu: 25 °C (1) ACD
Koc 12.1 pH 3; Iwọn otutu: 25 °C (1) ACD
Koc 12.1 pH 4; Iwọn otutu: 25 °C (1) ACD
Koc 12.1 pH 5; Iwọn otutu: 25 °C (1) ACD
Koc 12.1 pH 6; Iwọn otutu: 25 °C (1) ACD
Koc 12.1 pH 7; Iwọn otutu: 25 °C (1) ACD
Koc 11.6 pH 8; Iwọn otutu: 25 °C (1) ACD
Koc 8.45 pH 9; Iwọn otutu: 25 °C (1) ACD
Koc 2.33 pH 10; Iwọn otutu: 25 °C (1) ACD
logD -0.54 pH 1; Iwọn otutu: 25 °C (1) ACD
logD -0.54 pH 2; Iwọn otutu: 25 °C (1) ACD
logD -0.54 pH 3; Iwọn otutu: 25 °C (1) ACD
logD -0.54 pH 4; Iwọn otutu: 25 °C (1) ACD
logD -0.54 pH 5; Iwọn otutu: 25 °C (1) ACD
logD -0.54 pH 6; Iwọn otutu: 25 °C (1) ACD
logD -0.54 pH 7; Iwọn otutu: 25 °C (1) ACD
logD -0.56 pH 8; Iwọn otutu: 25 °C (1) ACD
logD -0.70 pH 9; Iwọn otutu: 25 °C (1) ACD
logD -1.25 pH 10; Iwọn otutu: 25 °C (1) ACD

 

Ohun ini Iye Ipo Orisun
logP -0.538± 0.456 Iwọn otutu: 25 °C (1) ACD
Ibi Isoju Agbekale 4.9 g/L Iwọn otutu: 25 °C (1) ACD
Ibi Solubility 4.9 g/L pH 1; Iwọn otutu: 25 °C (1) ACD
Ibi Solubility 4.9 g/L pH 2; Iwọn otutu: 25 °C (1) ACD
Ibi Solubility 4.9 g/L pH 3; Iwọn otutu: 25 °C (1) ACD
Ibi Solubility 4.9 g/L pH 4; Iwọn otutu: 25 °C (1) ACD
Ibi Solubility 4.9 g/L pH 5; Iwọn otutu: 25 °C (1) ACD
Ibi Solubility 4.9 g/L pH 6; Iwọn otutu: 25 °C (1) ACD
Ibi Solubility 4.9 g/L pH 7; Iwọn otutu: 25 °C (1) ACD
Ibi Solubility 5.2 g/L pH 8; Iwọn otutu: 25 °C (1) ACD
Ibi Solubility 6.9 g/L pH 9; Iwọn otutu: 25 °C (1) ACD
Ibi Solubility 25 g/L pH 10; Iwọn otutu: 25 °C (1) ACD
Ibi Solubility 4.9 g/L Omi ti a ko fi silẹ pH 5.53; Iwọn otutu: 25 °C (1) ACD
Solubility Inu inu Molar 0.020 mol/L Iwọn otutu: 25 °C (1) ACD
Solubility Molar 0.020 mol/L pH 1; Iwọn otutu: 25 °C (1) ACD
Solubility Molar 0.020 mol/L pH 2; Iwọn otutu: 25 °C (1) ACD
Solubility Molar 0.020 mol/L pH 3; Iwọn otutu: 25 °C (1) ACD
Solubility Molar 0.020 mol/L pH 4; Iwọn otutu: 25 °C (1) ACD
Solubility Molar 0.020 mol/L pH 5; Iwọn otutu: 25 °C (1) ACD
Solubility Molar 0.020 mol/L pH 6; Iwọn otutu: 25 °C (1) ACD
Solubility Molar 0.020 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 0.028 mol/L pH 9; Iwọn otutu: 25 °C (1) ACD
Solubility Molar 0.10 mol/L pH 10; Iwọn otutu: 25 °C (1) ACD
Solubility Molar 0.020 mol/L Omi ti a ko fi silẹ pH 5.53; Iwọn otutu: 25 °C (1) ACD
Òṣuwọn Molikula 246.19    
pKa 9.39 ± 0.10 Pupọ Epo otutu: 25 °C (1) ACD

(1) Iṣiro nipa lilo Idagbasoke Kemistri To ti ni ilọsiwaju (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

iwuwo

Ohun ini Iye Ipo Orisun
iwuwo 1,63 ± 0,1 g / cm3 Iwọn otutu: 20 °C; Tẹ: 760 Torr (1) ACD
Iwọn didun Molar 150,8 ± 5,0 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)

Lipinski

Ohun ini Iye Ipo Orisun
Larọwọto Rotatable Bonds 4   (1) ACD
H Awọn olugba 7   (1) ACD
H Awọn oluranlọwọ 3   (1) ACD
H Oluranlọwọ / Olugba Apapọ 10   (1) ACD
logP -0.538± 0.456 Iwọn otutu: 25 °C (1) ACD
Òṣuwọn Molikula 246.19    

(1) Iṣiro nipa lilo Idagbasoke Kemistri To ti ni ilọsiwaju (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Ilana Jẹmọ

Ohun ini Iye Orisun ipo
Pola dada Area 99.1 A2 (1) ACD

(1) Iṣiro nipa lilo Idagbasoke Kemistri To ti ni ilọsiwaju (ACD/Labs) Software V11.02 (© 1994-2023 ACD/Labs)

Spectra asọtẹlẹ

Spectra wa
1 H NMR
13 C NMR

GHS Ewu Gbólóhùn

Orisun Gbólóhùn Ewu koodu
H228 Flammable ri to 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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