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| CAS No.: | 2140-61-6 |
|---|---|
| Name: | 5-METHYLCYTIDINE |
| Molecular Structure: | |
|
|
|
| Formula: | C10H15N3O5 |
| Molecular Weight: | 257.246 |
| Synonyms: | 3:PN: US20060035254 PAGE: 63 claimed sequence;5-Methylcytidine;NSC 363933; |
| EINECS: | 218-390-8 |
| Density: | 1.79 g/cm3 |
| Melting Point: | 212-215 °C (dec.)(lit.) |
| Boiling Point: | 537.5 °C at 760 mmHg |
| Flash Point: | 278.9 °C |
| Appearance: | Light Yellow Crystals |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | 36/37/38 |
| Safety: | 26-36 |
| PSA: | 130.83000 |
| LogP: | -1.67340 |
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- 240444-70-62,3,5,6-Tetrafluor-4-(methoxymethyl)benzyl-2,2-dimethyl-3-(prop-1-en-1-yl)cyclopropancarboxylat
- 68439-39-4Poly(oxy-1,2-ethanediyl), alpha-(2-ethylhexyl)-omega-hydroxy-,
- 59237-68-2
2',3',5'-tri-O-benzoyl-5-methylcytidine
- 2140-61-6
5-methylcytidine
| Conditions | Yield |
|---|---|
| With sodium methylate In methanol for 14h; Ambient temperature; | 91% |
| With ammonia In methanol |
- 117862-70-1
N4,5-dimethylcytidine
- 2140-61-6
5-methylcytidine
| Conditions | Yield |
|---|---|
| With manganese(IV) oxide; C17H20N4O9P(1-)*Na(1+); oxygen In water; acetonitrile at 20℃; under 760.051 Torr; for 7h; Irradiation; chemoselective reaction; | 70% |
- 7323-83-3
4-methoxy-5-methyl-1-(tri-O-benzoyl-β-D-ribofuranosyl)-1H-pyrimidin-2-one
- 2140-61-6
5-methylcytidine
| Conditions | Yield |
|---|---|
| With ammonia In methanol at 100℃; for 21h; | 67% |
- 28585-48-0
O2',O3',O5'-tribenzoyl-5-methyl-4-thio-uridine
- 2140-61-6
5-methylcytidine
| Conditions | Yield |
|---|---|
| With ethanol; ammonia |
- 107-71-1
tert-butyl peroxyacetate
- 65-46-3
CYTIDINE
A
- 10578-79-7
4-methylamino-1-(β-D-ribofuranosyl)pyrimidin-2(1H)-one
B
- 2140-64-9
N3-methylcytidine
C
- 2140-61-6
5-methylcytidine
| Conditions | Yield |
|---|---|
| at 32℃; for 20h; Product distribution; Mechanism; Irradiation; solutions of pH 1.4 - 12.4; |
| Conditions | Yield |
|---|---|
| Multi-step reaction with 5 steps 1: SnCl4 2: NaHCO3 / H2O 3: 98 percent / Et3N; POCl3 / acetonitrile 4: NH3 / dioxane / 24 h / 20 °C 5: NH3 / methanol View Scheme | |
| Multi-step reaction with 2 steps 1: 99 percent / stannic chloride / acetonitrile / Ambient temperature 2: 67 percent / ammonia / methanol / 21 h / 100 °C View Scheme |
| Conditions | Yield |
|---|---|
| Multi-step reaction with 3 steps 1: 98 percent / Et3N; POCl3 / acetonitrile 2: NH3 / dioxane / 24 h / 20 °C 3: NH3 / methanol View Scheme | |
| Multi-step reaction with 2 steps 1: pyridine; P2S5 2: ethanol; NH3 View Scheme |
- 163496-05-7
C33H27N5O8
- 2140-61-6
5-methylcytidine
| Conditions | Yield |
|---|---|
| Multi-step reaction with 2 steps 1: NH3 / dioxane / 24 h / 20 °C 2: NH3 / methanol View Scheme |
- 2140-61-6
5-methylcytidine
| Conditions | Yield |
|---|---|
| Multi-step reaction with 4 steps 1: NaHCO3 / H2O 2: 98 percent / Et3N; POCl3 / acetonitrile 3: NH3 / dioxane / 24 h / 20 °C 4: NH3 / methanol View Scheme |
| Conditions | Yield |
|---|---|
| Multi-step reaction with 5 steps 1: SnCl4 2: NaHCO3 / H2O 3: 98 percent / Et3N; POCl3 / acetonitrile 4: NH3 / dioxane / 24 h / 20 °C 5: NH3 / methanol View Scheme |
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Specification
The Cytidine,5-methyl-, with CAS registry number 2140-61-6, belongs to the following product categories: (1)Biochemistry; (2)Nucleosides and their analogs; (3)Nucleosides, Nucleotides & Related Reagents; (4)Biochemicals and Reagents; (5)Nucleoside Analogs; (6)Nucleosides, Nucleotides, Oligonucleotides. It has the systematic name of 5-methylcytidine. And the chemical formula of this chemical is C10H15N3O5.
Physical properties of Cytidine,5-methyl-: (1)ACD/LogP: -1.35; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -1.35; (4)ACD/LogD (pH 7.4): -1.34; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 4.36; (8)ACD/KOC (pH 7.4): 4.42; (9)#H bond acceptors: 8; (10)#H bond donors: 5; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 72.83 Å2; (13)Index of Refraction: 1.725; (14)Molar Refractivity: 57.06 cm3; (15)Molar Volume: 143.6 cm3; (16)Polarizability: 22.62×10-24cm3; (17)Surface Tension: 77.4 dyne/cm; (18)Density: 1.79 g/cm3; (19)Flash Point: 278.9 °C; (20)Enthalpy of Vaporization: 93.67 kJ/mol; (21)Boiling Point: 537.5 °C at 760 mmHg; (22)Vapour Pressure: 8.5E-14 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
The Cytidine,5-methyl- irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C1/N=C(/N)\C(=C/N1[C@@H]2O[C@@H]([C@@H](O)[C@H]2O)CO)C
(2)InChI: InChI=1/C10H15N3O5/c1-4-2-13(10(17)12-8(4)11)9-7(16)6(15)5(3-14)18-9/h2,5-7,9,14-16H,3H2,1H3,(H2,11,12,17)/t5-,6-,7-,9-/m1/s1
(3)InChIKey: ZAYHVCMSTBRABG-JXOAFFINBK
(4)Std. InChI: InChI=1S/C10H15N3O5/c1-4-2-13(10(17)12-8(4)11)9-7(16)6(15)5(3-14)18-9/h2,5-7,9,14-16H,3H2,1H3,(H2,11,12,17)/t5-,6-,7-,9-/m1/s1
(5)Std. InChIKey: ZAYHVCMSTBRABG-JXOAFFINSA-N
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