Basic information
- CAS
54397-88-5- Standard SMILES
Nc1ccc(OP(=O)(O)OCC2OC(n3cc(F)c(=O)[nH]c3=O)CC2O)cc1- InChIKey
PXZLZKCYKJOBQJ-UHFFFAOYSA-N- Molecular formula
- C15H17FN3O8P
- Average molar mass
- 417.28 g/mol
- Monoisotopic mass
- 417.07372967
Names & identifiers
- Preferred name
- (4-Aminophenyl) [5-(5-fluoro-2,4-dioxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methyl hydrogen phosphate
- IUPAC
- (4-aminophenyl) [5-(5-fluoro-2,4-dioxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methyl hydrogen phosphate
- English name
- 5-Fluoro-2'-deoxyuridine 5'-(p-amino*phe nyl) monoph
- Molecular formula
- C15H17FN3O8P
- Molecular weight
- 417.28
Names & synonyms
54397-88-5AC1L1CAU(4-aminophenyl) [5-(5-fluoro-2,4-dioxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methyl hydrogen phosphateDTXSID502743355-fluoro-2'-deoxy-[5']uridylic acid mono-(4-amino-phenyl) ester1-{5-O-[(4-Aminophenoxy)(hydroxy)phosphoryl]-2-deoxypentofuranosyl}-5-fluoropyrimidine-2,4(1H,3H)-dione5-FLUORO-2´-DEOXYURIDINE 5´-(P-AMINO*PHE NYL) MONOPH5-Fluoro-2'-deoxyuridine 5'-(p-amino*phe nyl) monoph5-FLUORO-2'-DEOXYURIDINE 5'-(P-AMINOPHENYL) MONOP...5-fluoro-2'-deoxyuridine-5'-(p-aminophenyl)monophosphate5'-Uridylic acid, 2'-deoxy-5-fluoro-, mono(4-aminophenyl) ester (9CI)5-Fluoro-2μ-deoxyuridine 5μ-(p-aminophenyl) monophosphate free acid or salt as available
Database identifiers
- CAS
54397-88-5- PubChem CID
- 1815
- DTXSID
DTXSID50274335
Properties
Computed structural properties
- XLogP
- -1.1
- Topological polar surface area
- 161 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 6
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 699
Physicochemical properties
- storage temp.
- 20 °C · −20°C
- WGK Germany
- 3 · 3
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
Chemistry & industry
Suppliers1 total
上海梅凯科技有限公司15300790979 18964014359 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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