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1-(3-Chlorooxolan-2-yl)-5-fluoropyrimidine-2,4-dione

HCID 5207401
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Basic information

CAS
63883-04-5
Standard SMILES
O=c1[nH]c(=O)n(C2OCCC2Cl)cc1F
InChIKey
AAHZYBLNBHHSRG-UHFFFAOYSA-N
Molecular formula
C8H8ClFN2O3
Average molar mass
234.61 g/mol
Monoisotopic mass
234.020748

Names & identifiers

Preferred name
1-(3-Chlorooxolan-2-yl)-5-fluoropyrimidine-2,4-dione
IUPAC
1-(3-chlorooxolan-2-yl)-5-fluoropyrimidine-2,4-dione

Names & synonyms

AC1NPOCP63883-04-5DTXSID90409967SR-01000091474SR-01000091474-11-(3-Chlorooxolan-2-yl)-5-fluoropyrimidine-2,4(1H,3H)-dione

Database identifiers

CAS
63883-04-5
PubChem CID
5207401
DTXSID
DTXSID90409967

Properties

Computed structural properties

XLogP
0
Topological polar surface area
58.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
1
Heavy atoms
15
Formal charge
0
Complexity
347

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Compound notes

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