3-Hydroxy-1,8-naphthalic anhydride

C₁₂H₆O₄CAS 23204-36-6214.18 g/mol

Open in Covalent MOL file

Acid anhydride Phenol

Properties

Molecular formula: C₁₂H₆O₄
Molar mass: 214.18 g/mol
Exact mass: 214.0266 Da
logP: 1.86Crippen estimate
Polar surface area: 63.6 Å²
H-bond donors / acceptors: 1 / 4
Rotatable bonds: 0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

23204-36-6

SMILES

C1=CC2=CC(=CC3=C2C(=C1)C(=O)OC3=O)O

InChIKey

FKVNZFAMXGMPOU-UHFFFAOYSA-N

InChI

InChI=1S/C12H6O4/c13-7-4-6-2-1-3-8-10(6)9(5-7)12(15)16-11(8)14/h1-5,13H

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with 3-Hydroxy-1,8-naphthalic anhydride

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,8-Naphthalic anhydride81-84-566 % similar 5-Nitro-1H,3H-naphtho[1,8-cd]pyran-1,3-dione3027-38-156 % similar 4-Hydroxyphthalic anhydride27550-59-053 % similar 2,3-Naphthalenedicarboxylic anhydride716-39-249 % similar 3-Hydroxyphthalic anhydride37418-88-546 % similar Naphthalenetetracarboxylic dianhydride81-30-145 % similar Phthalic anhydride85-44-945 % similar 4-Chloro-1,8-naphthalic anhydride4053-08-144 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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