1-(6-Methoxy-2-naphthyl)ethanol

C₁₃H₁₄O₂CAS 77301-42-9202.25 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₃H₁₄O₂
Molar mass: 202.25 g/mol
Exact mass: 202.0994 Da
Melting point: 113.5–114.5 °C
logP: 2.90Crippen estimate
Polar surface area: 29.5 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 2

Hazards

Warning

H302+H312+H332 Harmful if swallowed, in contact with skin or if inhaled97.5% of notifiers
H302 Harmful if swallowed100% of notifiers
H312 Harmful in contact with skin97.5% of notifiers
H332 Harmful if inhaled97.5% of notifiers
H413 May cause long lasting harmful effects to aquatic life97.5% of notifiers

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, P501

Identifiers

CAS number

77301-42-9

SMILES

COc1ccc2cc(C(C)O)ccc2c1

InChIKey

OUVJWFRUESFCCY-UHFFFAOYSA-N

InChI

InChI=1S/C13H14O2/c1-9(14)10-3-4-12-8-13(15-2)6-5-11(12)7-10/h3-9,14H,1-2H3

Weigh it out

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Names and synonyms

9 names

2-Naphthalenemethanol, 6-methoxy-α-methyl-
6-Methoxy-α-methyl-2-naphthalenemethanol
α-(6-Methoxy-2-naphthyl)ethyl alcohol
α-(6-Methoxy-2-naphthyl)ethanol
(±)-1-(6-Methoxynaphthyl)ethanol
1-(6′-Methoxy-2-naphthyl)ethanol
2-(1-Hydroxyethyl)-6-methoxynaphthalene
1-(6-Methoxynaphthalen-2-yl)ethanol
1-(6-Methoxynaphthalen-2-yl)ethan-1-ol

Work with 1-(6-Methoxy-2-naphthyl)ethanol

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

(S)-1-(4-Methoxyphenyl)ethanol1572-97-068 % similar 1-(4-Methoxyphenyl)ethanol3319-15-168 % similar (S)-(-)-Alpha-methyl-2-naphthalenemethanol27544-18-961 % similar Alpha-Methylnaphthalene-2-methanol40295-80-561 % similar Alpha-Methylnaphthalene-2-methanol7228-47-961 % similar 2,6-Dimethoxynaphthalene5486-55-559 % similar Naproxen22204-53-156 % similar (R)-Naproxen23979-41-156 % similar

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

Same formula

Demethoxyencecalin19013-07-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook