2-Bromo-7-hydroxynaphthalene

C₁₀H₇BrOCAS 116230-30-9223.07 g/mol

Open in Covalent MOL file

Aryl halide Phenol

Properties

Molecular formula: C₁₀H₇BrO
Molar mass: 223.07 g/mol
Exact mass: 221.9680 Da
logP: 3.31Crippen estimate
Polar surface area: 20.2 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Hazards

Danger

H315 Causes skin irritation100% of notifiers
H318 Causes serious eye damage97.7% of notifiers
H335 May cause respiratory irritation97.7% of notifiers

Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

116230-30-9

SMILES

C1=CC(=CC2=C1C=CC(=C2)Br)O

InChIKey

VWSBGGRCEQOTNU-UHFFFAOYSA-N

InChI

InChI=1S/C10H7BrO/c11-9-3-1-7-2-4-10(12)6-8(7)5-9/h1-6,12H

Weigh it out

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

Names and synonyms

1 names

7-Bromo-2-naphthol

Work with 2-Bromo-7-hydroxynaphthalene

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

2,7-Naphthalenediol582-17-271 % similar 2,7-Dibromonaphthalene58556-75-571 % similar 2,6-Dibromoanthracene186517-01-161 % similar 2,6-Dibromonaphthalene13720-06-459 % similar 2,6-Dihydroxynaphthalene581-43-159 % similar 2-Naphthol135-19-356 % similar 2-Bromonaphthalene580-13-256 % similar 3-Bromophenol591-20-854 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

6-Bromo-2-naphthalenol15231-91-1 4-Bromonaphthalen-2-ol5498-31-7 4-Bromonaphthalen-1-ol571-57-3 1-Bromo-2-hydroxynaphthalene573-97-7 2-Bromo-1-naphthol771-15-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook