2-(Hydroxymethyl)-3-hydroxypyridine hydrochloride

C₆H₈ClNO₂CAS 14173-30-9161.59 g/mol

Open in Covalent MOL file

Alcohol Phenol

Properties

Molecular formula: C₆H₈ClNO₂
Molar mass: 161.59 g/mol
Exact mass: 161.0244 Da
Melting point: 206 °C
logP: 0.70Crippen estimate
Polar surface area: 53.4 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 1

Hazards

Warning

H302 Harmful if swallowed97.6% of notifiers
H312 Harmful in contact with skin97.6% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled97.6% of notifiers
H335 May cause respiratory irritation97.6% of notifiers

Aggregated from 42 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, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

14173-30-9

SMILES

Cl.OCc1ncccc1O

InChIKey

SKVRYQUMKJQZFN-UHFFFAOYSA-N

InChI

InChI=1S/C6H7NO2.ClH/c8-4-5-6(9)2-1-3-7-5;/h1-3,8-9H,4H2;1H

Weigh it out

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

Names and synonyms

5 names

2-Pyridinemethanol, 3-hydroxy-, hydrochloride (1:1)
2-Pyridinemethanol, 3-hydroxy-, hydrochloride
3-Hydroxy-2-pyridinemethanol hydrochloride
3-Hydroxy-2-(hydroxymethyl)pyridine hydrochloride
2-(Hydroxymethyl)pyridin-3-ol hydrochloride

Work with 2-(Hydroxymethyl)-3-hydroxypyridine hydrochloride

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

(3-Bromopyridin-2-yl)methanol52378-64-053 % similar 3-Fluoro-2-pyridinemethanol31181-79-052 % similar 2,2'-Bipyridine-3,3'-diol36145-03-648 % similar 2,3-Dihydroxypyridine16867-04-245 % similar 2,3-Pyridinediol84719-32-445 % similar 2-Methylpyridin-3-ol1121-25-142 % similar 2-Amino-3-hydroxypyridine16867-03-142 % similar 2-Fluoro-3-pyridinol174669-74-042 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Aminobenzene-1,3-diol hydrochloride34781-86-7 5-Aminobenzene-1,3-diol hydrochloride6318-56-5 2-Aminoresorcinol hydrochloride634-60-6

Elsewhere

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