1-Hydroxy-3,5-dimethyladamantane

C₁₂H₂₀OCAS 707-37-9180.29 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₂H₂₀O
Molar mass: 180.29 g/mol
Exact mass: 180.1514 Da
Melting point: 94 °C
logP: 2.73Crippen estimate
Polar surface area: 20.2 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Identifiers

CAS number

707-37-9

SMILES

CC12CC3CC(C)(C1)CC(O)(C3)C2

InChIKey

LBWCITVBZLTEKW-UHFFFAOYSA-N

InChI

InChI=1S/C12H20O/c1-10-3-9-4-11(2,6-10)8-12(13,5-9)7-10/h9,13H,3-8H2,1-2H3

Weigh it out

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

Names and synonyms

9 names

Tricyclo[3.3.1.13,7]decan-1-ol, 3,5-dimethyl-
1-Adamantanol, 3,5-dimethyl-
3,5-Dimethyltricyclo[3.3.1.13,7]decan-1-ol
3,5-Dimethyl-1-adamantanol
1,3-Dimethyl-5-hydroxyadamantane
3,5-Dimethyl-1-hydroxyadamantane
1,3-Dimethyl-5-adamantanol
NSC 102294
5,7-Dimethyl-3-adamantanol

Work with 1-Hydroxy-3,5-dimethyladamantane

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

Same formula

(E,E)-2,4-Dodecadienal21662-16-8 Tricyclo[3.3.1.13,7]decane-1-ethanol6240-11-5 2-Cyclohexylcyclohexanone90-42-6

Elsewhere

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