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[3-Hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl phenyl carbonate

HCID 309447
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Basic information

CAS
5864-33-5
Standard SMILES
Cc1cn(C2CC(O)C(COC(=O)Oc3ccccc3)O2)c(=O)[nH]c1=O
InChIKey
SRQCEBSEXUVGCA-UHFFFAOYSA-N
Molecular formula
C17H18N2O7
Average molar mass
362.3 g/mol
Monoisotopic mass
362.11140092

Names & identifiers

Preferred name
[3-Hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl phenyl carbonate
IUPAC
[3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl phenyl carbonate

Names & synonyms

NSC2117215864-33-5DTXSID30309316NSC-2117211-[2-Deoxy-5-O-(phenoxycarbonyl)pentofuranosyl]-5-methylpyrimidine-2,4(1H,3H)-dione

Database identifiers

CAS
5864-33-5
PubChem CID
309447
DTXSID
DTXSID30309316

Properties

Computed structural properties

XLogP
0.8
Topological polar surface area
114 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
26
Formal charge
0
Complexity
600

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