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4-(6-Chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol

HCID 429341
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Basic information

CAS
64332-71-4
Standard SMILES
OCC1OCC(n2cnc3c(Cl)ncnc32)C1O
InChIKey
FQEZWWMHJGCZJY-UHFFFAOYSA-N
Molecular formula
C10H11ClN4O3
Average molar mass
270.67 g/mol
Monoisotopic mass
270.0519679

Names & identifiers

Preferred name
4-(6-Chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol
IUPAC
4-(6-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol

Names & synonyms

64332-71-4NSC2539414-(6-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-olDTXSID60330411NSC-2539411,4-Anhydro-2-(6-chloro-9H-purin-9-yl)-2-deoxypentitol

Database identifiers

CAS
64332-71-4
PubChem CID
429341
DTXSID
DTXSID60330411

Properties

Computed structural properties

XLogP
-0.1
Topological polar surface area
93.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
2
Heavy atoms
18
Formal charge
0
Complexity
311

Related reactions

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Compound notes

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