6-chloro-3-chloromethyl-3H-oxazolo[4,5-b]pyridin-2-one

HCID 21426073

Notes Reactions

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Basic information

Standard SMILES: O=c1oc2cc(Cl)cnc2n1CCl
InChIKey: TUWOEDOQOKTAAA-UHFFFAOYSA-N
Molecular formula: C7H4Cl2N2O2
Average molar mass: 219.02 g/mol

Names & identifiers

Preferred name: 6-chloro-3-chloromethyl-3H-oxazolo[4,5-b]pyridin-2-one
IUPAC: 6-chloro-3-(chloromethyl)-[1,3]oxazolo[4,5-b]pyridin-2-one

Names & synonyms

35570-70-86-chloro-3-chloromethyl-3H-oxazolo[4,5-b]pyridin-2-one6-Chloro-3-(chloromethyl)oxazolo[4,5-b]pyridin-2(3H)-oneSCHEMBL11755747DB-1970853-chloromethyl-6-chloro-oxazolo[4,5-b]pyridin-2-(3H)-one

Database identifiers

PubChem CID: 21426073

Properties

Computed structural properties

XLogP: 1.9
Topological polar surface area: 42.4 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 1
Heavy atoms: 13
Formal charge: 0
Complexity: 227

Related reactions

1 records

New reaction record

HRID 258572As productuspto-grants-1977_07

Compound notes

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