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Name |
Ribal |
EINECS | N/A |
CAS No. | 96761-00-1 | Density | 1.31 g/cm3 |
PSA | 49.69000 | LogP | -0.74790 |
Solubility | N/A | Melting Point |
N/A |
Formula | C5H8O3 | Boiling Point | 260.925 °C at 760 mmHg |
Molecular Weight | 116.117 | Flash Point | 111.604 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
1,4-Anhydro-2-deoxy-D-erythro-pent-1-enitol; |
Article Data | 8 |
(2R,3S)-2-Triisopropylsilanyloxymethyl-2,3-dihydro-furan-3-ol
1,4-anhydro-2-deoxy-D-erythro-pent-1-enitol
Conditions | Yield |
---|---|
With tetrabutyl ammonium fluoride In tetrahydrofuran for 0.0166667h; | 98% |
thymidine
1,4-anhydro-2-deoxy-D-erythro-pent-1-enitol
Conditions | Yield |
---|---|
With ammonium sulfate; 1,1,1,3,3,3-hexamethyl-disilazane for 4h; Heating; | 80% |
Stage #1: thymidine With ammonium sulfate; 1,1,1,3,3-pentamethyldisilazane for 2h; Reflux; Stage #2: With tetrabutyl ammonium fluoride In tetrahydrofuran at 20℃; for 3h; | 56% |
Stage #1: thymidine With ammonium sulfate; 1,1,1,3,3,3-hexamethyl-disilazane at 130℃; for 2h; Stage #2: With tetrabutyl ammonium fluoride In tetrahydrofuran at 20℃; for 3h; | 50% |
2,3-O-Isopropylidene-5-O-trityl-α,β-ribofuranosyl chloride
1,4-anhydro-2-deoxy-D-erythro-pent-1-enitol
Conditions | Yield |
---|---|
With ammonia; lithium In tetrahydrofuran for 2h; |
2'-Deoxyguanosine
17β-Estradiol-3,4-quinone
A
1,4-anhydro-2-deoxy-D-erythro-pent-1-enitol
Conditions | Yield |
---|---|
With acetic acid In water; N,N-dimethyl-formamide at 22℃; pH=4.0; Product distribution; |
2'-Deoxyguanosine
hexestrol-3',4'-quinone
A
1,4-anhydro-2-deoxy-D-erythro-pent-1-enitol
Conditions | Yield |
---|---|
With acetic acid In water; N,N-dimethyl-formamide at 22℃; pH=4.0; Product distribution; |
1,4-anhydro-2-deoxy-D-erythro-pent-1-enitol
1,3-Dichloro-1,1,3,3-tetraisopropyldisiloxane
1,4-anhydro-2-deoxy-3,5-O-(1,1,3,3-tetraisopropyldisiloxane-1,3-diyl)-D-erythro-pent-1-enitol
Conditions | Yield |
---|---|
With 1H-imidazole In N,N-dimethyl-formamide | 80% |
1,4-anhydro-2-deoxy-D-erythro-pent-1-enitol
8-iodo-2-methyl-4-(N-methyl-N-phenylamino)pyrazolo[1,5-a]-1,3,5-triazin-4-one
2-methyl-4-(N-methyl-N-phenylamino)-8-(β-D-glycero-pentofuran-3'-ulose-1'-yl)pyrazolo[1,5-a]-1,3,5-triazine
Conditions | Yield |
---|---|
With tributyl-amine; triphenyl-arsane; bis(dibenzylideneacetone)-palladium(0) In acetonitrile at 60℃; for 18h; | 75% |
1,4-anhydro-2-deoxy-D-erythro-pent-1-enitol
Conditions | Yield |
---|---|
With tributyl-amine; triphenyl-arsane; bis(dibenzylideneacetone)-palladium(0) In N,N-dimethyl-formamide at 100℃; Heck Reaction; Inert atmosphere; regioselective reaction; | 60% |
8-iodo-4-(N-methyl-N-phenylamino)pyrazolo[1,5-a]-1,3,5-triazine
1,4-anhydro-2-deoxy-D-erythro-pent-1-enitol
Conditions | Yield |
---|---|
With triphenyl-arsane; triethylamine; bis(dibenzylideneacetone)-palladium(0) In acetonitrile at 100℃; for 16h; Solvent; Reagent/catalyst; | 34% |
With tributyl-amine; triphenyl-arsane; bis(dibenzylideneacetone)-palladium(0) In acetonitrile at 60℃; for 12.25h; | |
With triphenyl-arsane; triethylamine; bis(dibenzylideneacetone)-palladium(0) In acetonitrile at 82℃; for 16h; |
1,4-anhydro-2-deoxy-D-erythro-pent-1-enitol
8-(2'-deoxy-β-D-ribofuranosyl)-2-methyl-4-(N-methyl-N-phenylamino)pyrazolo[1,5-a]-1,3,5-triazine
Conditions | Yield |
---|---|
Multi-step reaction with 2 steps 1: 75 percent / bis(dibenzylideneacetone)palladium(0); Ph3As; (n-Bu)3N / acetonitrile / 18 h / 60 °C 2: 92 percent / sodium triacetoxyborohydride / acetonitrile / 0.33 h / 20 °C View Scheme |
The IUPAC name of this chemical is (2R,3S)-2-(hydroxymethyl)-2,3-dihydrofuran-3-ol. With the CAS registry number 96761-00-1, it is also named as 1,4-Anhydro-2-deoxy-D-erythro-pent-1-enitol; Ribal. The formula is C5H8O3 and the molecular weight is 116.11522.
The other characteristics of (2R,3S)-2-(Hydroxymethyl)-2,3-dihydrofuran-3-ol can be summarized as: (1)ACD/LogP: -1.40; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.4; (4)ACD/LogD (pH 7.4): -1.4; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 4.13; (8)ACD/KOC (pH 7.4): 4.13; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Index of Refraction: 1.532; (13)Molar Refractivity: 27.47 cm3; (14)Molar Volume: 88.6 cm3; (15)Polarizability: 10.89×10-24 cm3; (16)Surface Tension: 57.4 dyne/cm; (17)Enthalpy of Vaporization: 57.91 kJ/mol; (18)Vapour Pressure: 0.00171 mmHg at 25°C; (19)Rotatable Bond Count: 1; (20)Exact Mass: 116.047344; (21)MonoIsotopic Mass: 116.047344; (22)Topological Polar Surface Area: 49.7; (23)Heavy Atom Count: 8; (24)Complexity: 99.8; (25)Defined Atom StereoCenter Count: 2.
People can use the following data to convert to the molecule structure.
1. SMILES:O[C@H]1/C=C\O[C@@H]1CO
2. InChI:InChI=1/C5H8O3/c6-3-5-4(7)1-2-8-5/h1-2,4-7H,3H2/t4-,5+/m0/s1
3. InChIKey:SGOSIWMWLVSBIC-CRCLSJGQBA
4. Std. InChI:InChI=1S/C5H8O3/c6-3-5-4(7)1-2-8-5/h1-2,4-7H,3H2/t4-,5+/m0/s1
5. Std. InChIKey:SGOSIWMWLVSBIC-CRCLSJGQSA-N