3-(Hydroxymethyl)adamantan-1-ol

C₁₁H₁₈O₂CAS 38584-37-1182.26 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₁H₁₈O₂
Molar mass: 182.26 g/mol
Exact mass: 182.1307 Da
logP: 1.31Crippen estimate
Polar surface area: 40.5 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 1

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

38584-37-1

SMILES

C1C2CC3(CC1CC(C2)(C3)O)CO

InChIKey

FORAJDRXEYKDFJ-UHFFFAOYSA-N

InChI

InChI=1S/C11H18O2/c12-7-10-2-8-1-9(3-10)5-11(13,4-8)6-10/h8-9,12-13H,1-7H2

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Names and synonyms

1 names

3-(Hydroxymethyl)-1-adamantol

Work with 3-(Hydroxymethyl)adamantan-1-ol

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

1,3-Dihydroxyadamantane5001-18-363 % similar Tricyclo[3.3.1.13,7]decane-1-methanol770-71-856 % similar 2-(3-Hydroxyadamantan-1-yl)acetic acid17768-36-453 % similar 3-Amino-1-adamantanol702-82-952 % similar 1-Adamantanol768-95-648 % similar 3-Hydroxyadamantane-1-carboxylic acid42711-75-143 % similar 2-(3-Hydroxy-1-adamantyl)-2-oxoacetic acid709031-28-739 % similar Tricyclo[3.3.1.13,7]decane-1-ethanol6240-11-538 % similar

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

Same formula

Ethyl 2-nonynoate10031-92-2 Geranyl formate105-86-2 1-Ethylcyclopentyl ester266308-58-1 10-Undecynoic acid2777-65-3 (Z)-3-Hexenyl tiglate67883-79-8 1-Methylcyclohexyl methacrylate76392-14-8

Elsewhere

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