UDP
- Iupac Name：[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,
4-dihydroxyoxolan-2-yl]methyl phosphono hydrogen phosphate
- CAS No.: 58-98-0
- Molecular Weight：404.16
- Modify Date.: 2023-03-10 07:30
- Introduction: Solid
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1. Names and Identifiers
- 1.1 Name
- UDP
- 1.2 Synonyms
5-{[Hydroxy(phosphonooxy)phosphoryl]oxy}uridine 5'-URIDYLATE DIPHOSPHATE 5'-uridylate diphosphate (UDP) uridine 5'-(trihydrogen diphosphate) uridine 5'-(trihydrogen pyrophosphate) URIDINE 5'-DIPHOSPHATE uridine 5'-pyrophosphate Uridine, 5-[[hydroxy(phosphonooxy)phosphinyl]oxy]- uridine-5'-diphosphate Uridine-5'-diphosphate disodium salt (UDP) Uridine-5''-diphosphoric acid (and/or unspecified salts) uridinediphosphate
- 1.3 CAS No.
- 58-98-0
- 1.4 CID
- 6031
- 1.5 EINECS(EC#)
- 200-409-6
- 1.6 Molecular Formula
- C9H14N2O12P2 (isomer)
- 1.7 Inchi
- InChI=1S/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1
- 1.8 InChkey
- XCCTYIAWTASOJW-XVFCMESISA-N
- 1.9 Canonical Smiles
- O[C@H]1[C@@H](O)[C@@H](O[C@@H]1COP(O)(=O)OP(O)(O)=O)N1C=CC(=O)NC1=O
- 1.10 Isomers Smiles
- C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)O)O)O
2. Properties
- 2.1 Density
- 2.002±0.06 g/cm3(Predicted)
- 2.1 Boiling point
- °Cat760mmHg
- 2.1 Refractive index
- 1.643
- 2.1 Flash Point
- °C
- 2.1 Precise Quality
- 465.97700
- 2.1 PSA
- 252.35000
- 2.1 logP
- -1.80580
- 2.1 pKa
- 1.04±0.50(Predicted)
- 2.2 StorageTemp
- Inert atmosphere,Store in freezer, under -20°C
3. Safety and Handling
- 3.1 Risk Statements
- 26-36
- 3.1 Safety Statements
- 36/37/38
- 3.1 RIDADR
- UN 2910 7
- 3.1 Safety
-
Hazard Codes: 
Xi,
R
Risk Statements: 36/37/38
R36/37/38: Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36: Wear suitable protective clothing.
RIDADR: UN 2910 7
WGK Germany: -
4. MSDS
2.Hazard identification
2.1 Classification of the substance or mixture
no data available
2.2 GHS label elements, including precautionary statements
| Pictogram(s) | no data available |
| Signal word | no data available |
| Hazard statement(s) | no data available |
| Precautionary statement(s) | |
| Prevention | no data available |
| Response | no data available |
| Storage | no data available |
| Disposal | no data available |
2.3 Other hazards which do not result in classification
no data available
6. Synthesis Route
58-98-0Total: 30 Synthesis Route
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Literatures:
The Nucleic Acids, Bd. 3 S. 323, 331
Journal of Biological Chemistry, , vol. 209, p. 1,13
Acta Chemica Scandinavica (1947-1973), , vol. 9, p. 251,254
Yield: null
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8. Computational chemical data
- Molecular Weight: 404.16g/mol
- Molecular Formula: C9H14N2O12P2
- Compound Is Canonicalized: True
- XLogP3-AA: null
- Exact Mass: 404.00219788
- Monoisotopic Mass: 404.00219788
- Complexity: 676
- Rotatable Bond Count: 6
- Hydrogen Bond Donor Count: 6
- Hydrogen Bond Acceptor Count: 12
- Topological Polar Surface Area: 212
- Heavy Atom Count: 25
- Defined Atom Stereocenter Count: 4
- Undefined Atom Stereocenter Count: 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Isotope Atom Count: 0
- Covalently-Bonded Unit Count: 1
- CACTVS Substructure Key Fingerprint: AAADccBzPAMAAAAAAAAAAAAAAAAAASAAAAAgAAAAAAAAAAAAAAAAHgAQCCAACBThgAYBAAPABxCIQCFWUICAAAAAAgAIAAAIAECDEAIAgAAOQAAPFyITAMDwMAIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==
9. Recommended Suppliers
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- Products:Chemical products
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- Email:sales-gc@dycnchem.com
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- Products:pharmaceutical intermediates and fine chemical products
- Tel:+86-531-58897022
UDP
- Purity:99%Packing: 200kg/bag FOB
- Price: 1 USD/kilogram
- Time: 2019/09/27
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