chempirical

4-(1-Adamantyl)phenol

C16H20OCAS 29799-07-3228.34 g/mol

Open in Covalent MOL file
HO
Phenol

Properties

Molecular formula
C16H20O
Molar mass
228.34 g/mol
Exact mass
228.1514 Da
logP
3.86Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
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
29799-07-3
SMILES
C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)O
InChIKey
KZMYFIUFUAOZHP-UHFFFAOYSA-N
InChI
InChI=1S/C16H20O/c17-15-3-1-14(2-4-15)16-8-11-5-12(9-16)7-13(6-11)10-16/h1-4,11-13,17H,5-10H2

Weigh it out

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Work with 4-(1-Adamantyl)phenol

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

Bis(4-hydroxyphenyl)diphenylmethane1844-01-545 % similar 4-(Triphenylmethyl)phenol978-86-945 % similar 2-(1-Adamantyl)-4-bromophenol104224-68-244 % similar 4,4′-(1,3-Dimethylbutylidene)bis[phenol]6807-17-644 % similar Bisphenol B77-40-744 % similar Bisphenol Z843-55-042 % similar Tris(4-hydroxyphenyl)ethane27955-94-841 % similar 4-(Trifluoromethyl)phenol402-45-941 % similar

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

Elsewhere

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