5-Amino-4-hydroxy-2-(2-methoxyphenyl)furan-3-one

HCID 435546

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 80913-81-1
Standard SMILES: COc1ccccc1C1OC(N)=C(O)C1=O
InChIKey: JGFAFTAQNNPZFR-UHFFFAOYSA-N
Molecular formula: C11H11NO4
Average molar mass: 221.21 g/mol
Monoisotopic mass: 221.06880783

Names & identifiers

Preferred name: 5-Amino-4-hydroxy-2-(2-methoxyphenyl)furan-3-one
IUPAC: 5-amino-4-hydroxy-2-(2-methoxyphenyl)furan-3-one

Names & synonyms

80913-81-15-amino-4-hydroxy-2-(2-methoxyphenyl)furan-3-oneNSC3720665-Amino-4-hydroxy-2-(2-methoxy-phenyl)-furan-3-oneSCHEMBL19610768SCHEMBL30658754DTXSID10331130NSC-3720665-Amino-4-hydroxy-2-(2-methoxyphenyl)furan-3(2H)-one

Database identifiers

CAS: 80913-81-1
PubChem CID: 435546
DTXSID: DTXSID10331130

Properties

Computed structural properties

XLogP: 1.1
Topological polar surface area: 81.8 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 5
Rotatable bonds: 2
Heavy atoms: 16
Formal charge: 0
Complexity: 326

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…