3-Phenylnaphthalen-1-ol

C₁₆H₁₂OCAS 30069-65-9220.27 g/mol

Open in Covalent MOL file

Phenol

Properties

Molecular formula: C₁₆H₁₂O
Molar mass: 220.27 g/mol
Exact mass: 220.0888 Da
logP: 4.21Crippen estimate
Polar surface area: 20.2 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

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

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

30069-65-9

SMILES

C1=CC=C(C=C1)C2=CC3=CC=CC=C3C(=C2)O

InChIKey

MAPYOCUYNJWAJW-UHFFFAOYSA-N

InChI

InChI=1S/C16H12O/c17-16-11-14(12-6-2-1-3-7-12)10-13-8-4-5-9-15(13)16/h1-11,17H

Weigh it out

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

Work with 3-Phenylnaphthalen-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-Dihydroxynaphthalene132-86-557 % similar 9-Phenylanthracene602-55-150 % similar 1-Naphthol90-15-348 % similar 9-Phenylphenanthrene844-20-247 % similar 2-Phenylnaphthalene612-94-246 % similar 2,3-Dihydroxynaphthalene92-44-446 % similar 1,3,5-Triphenylbenzene612-71-546 % similar 1,6-Dihydroxynaphthalene575-44-044 % similar

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

Same formula

1-[4-(2-Phenylethynyl)phenyl]ethanone1942-31-0 9-Acetylphenanthrene2039-77-2 9-Acetylanthracene784-04-3 2,5-Diphenylfuran955-83-9

Elsewhere

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