3,4'-Dihydroxybutyranilide

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Basic information

CAS: 19213-09-3
Standard SMILES: CC(O)CC(=O)Nc1ccc(O)cc1
InChIKey: OUEBAIFFOZTZEO-UHFFFAOYSA-N
Molecular formula: C10H13NO3
Average molar mass: 195.21 g/mol
Monoisotopic mass: 195.08954328

Names & identifiers

Preferred name: 3,4'-Dihydroxybutyranilide
IUPAC: 3-hydroxy-N-(4-hydroxyphenyl)butanamide

Names & synonyms

19213-09-3N-(beta-Hydroxybutyryl)-p-aminophenol3,4'-Dihydroxybutyranilide3-hydroxy-N-(4-hydroxyphenyl)butanamideCCRIS 7461Butyranilide, 3,4'-dihydroxy-DTXSID10940862

Database identifiers

CAS: 19213-09-3
PubChem CID: 146478
DTXSID: DTXSID10940862
Nikkaji: J1.408.294H

Properties

Computed structural properties

XLogP: 1
Topological polar surface area: 69.6 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 14
Formal charge: 0
Complexity: 188

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Compound notes

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