5-Hydroxy-2-adamantanone

C10H14O2CAS 20098-14-0166.22 g/mol

Open in Covalent MOL file
OOH
AlcoholKetone

Properties

Molecular formula
C10H14O2
Molar mass
166.22 g/mol
Exact mass
166.0994 Da
Melting point
318 °C
logP
1.13Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

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

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
20098-14-0
SMILES
O=C1C2CC3CC1CC(O)(C3)C2
InChIKey
TZBDEVBNMSLVKT-UHFFFAOYSA-N
InChI
InChI=1S/C10H14O2/c11-9-7-1-6-2-8(9)5-10(12,3-6)4-7/h6-8,12H,1-5H2

Weigh it out

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

Names and synonyms

11 names
  • Tricyclo[3.3.1.13,7]decan-2-one, 5-hydroxy-
  • 2-Adamantanone, 5-hydroxy-
  • Tricyclo[3.3.1.13,7]decanone, 5-hydroxy-
  • 5-Hydroxytricyclo[3.3.1.13,7]decan-2-one
  • 4-Oxo-1-adamantanol
  • 5-Hydroxyadamantanone
  • 1-Hydroxy-4-adamantanone
  • 1-Hydroxy-4-ketoadamantane
  • Kemantane
  • Idramantone
  • Kemantan

Work with 5-Hydroxy-2-adamantanone

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-Adamantanol768-95-654 % similar 5-Chloro-2-adamantanone20098-17-353 % similar Adamantanone700-58-346 % similar 1,3-Dihydroxyadamantane5001-18-339 % similar 3-Hydroxyadamantane-1-carboxylic acid42711-75-139 % similar trans-4-Aminoadamantan-1-ol hydrochloride62075-23-437 % similar 1,3,5-Adamantanetriol99181-50-737 % similar 2-(3-Hydroxyadamantan-1-yl)acetic acid17768-36-437 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Phenylacetaldehyde dimethyl acetal101-48-4 Camphoroquinone10334-26-6 Bornane-2,3-dione10373-78-1 4-Butoxyphenol122-94-1 1,4-Diethoxybenzene122-95-2 2-Hexanoylfuran14360-50-0 Hexahydro-2,5-methanopentalene-3a(1H)-carboxylic acid16200-53-6 4-Butylresorcinol18979-61-8

Elsewhere

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