6-Hydroxy-1-indanone

C₉H₈O₂CAS 62803-47-8148.16 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₉H₈O₂
Molar mass: 148.16 g/mol
Exact mass: 148.0524 Da
Melting point: 152 °C
logP: 1.52Crippen estimate
Polar surface area: 37.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0

Hazards

Warning

H302 Harmful if swallowed97.7% of notifiers
H315 Causes skin irritation100% of notifiers
H317 May cause an allergic skin reaction95.3% of notifiers
H319 Causes serious eye irritation100% of notifiers

Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P272, P280, P301+P317, P302+P352, P305+P351+P338, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P501

Identifiers

CAS number

62803-47-8

SMILES

O=C1CCc2ccc(O)cc21

InChIKey

MOANRQDXNNXOLW-UHFFFAOYSA-N

InChI

InChI=1S/C9H8O2/c10-7-3-1-6-2-4-9(11)8(6)5-7/h1,3,5,10H,2,4H2

Weigh it out

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

Names and synonyms

6 names

6-Hydroxyindan-1-one
1H-Inden-1-one, 2,3-dihydro-6-hydroxy-
1-Indanone, 6-hydroxy-
2,3-Dihydro-6-hydroxy-1H-inden-1-one
6-Hydroxy-2,3-dihydro-1H-inden-1-one
6-Hydroxy-2,3-dihydroinden-1-one

Work with 6-Hydroxy-1-indanone

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

3,4-Dihydro-7-hydroxy-1(2H)-naphthalenone22009-38-781 % similar 6-Bromoindanone14548-39-164 % similar 6-Hydroxy-3,4-dihydro-1(2H)-naphthalenone3470-50-660 % similar 6-Chloro-1-indanone14548-38-059 % similar 6-Fluoro-1-indanone1481-32-959 % similar 6-Methyl-1-indanone24623-20-959 % similar 1-Indanone-6-carboxylic acid60031-08-558 % similar 6-Methoxy-1-indanone13623-25-154 % similar

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

Same formula

4-Vinylbenzoic acid1075-49-6 Dihydrocoumarin119-84-6 5-Methoxybenzofuran13391-28-1 Cinnamic acid140-10-3 3,4-Dihydro-1H-2-benzopyran-4-one20924-56-5 4-Acetylbenzaldehyde3457-45-2 5-Hydroxy-1-indanone3470-49-3 4-Hydroxyindan-1-one40731-98-4

Elsewhere

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