4-Methoxy-3,5-dimethyl-2-pyridinemethanol

C₉H₁₃NO₂CAS 86604-78-6167.21 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₉H₁₃NO₂
Molar mass: 167.21 g/mol
Exact mass: 167.0946 Da
Boiling point: 115–135 °C (at 0.01 Torr)
logP: 1.20Crippen estimate
Polar surface area: 42.4 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 2

Hazards

Warning

H315 Causes skin irritation93.8% of notifiers
H319 Causes serious eye irritation93.8% of notifiers
H335 May cause respiratory irritation92.2% of notifiers

Aggregated from 64 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+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

86604-78-6

SMILES

COc1c(C)cnc(CO)c1C

InChIKey

PSEPRWKZZJWRCB-UHFFFAOYSA-N

InChI

InChI=1S/C9H13NO2/c1-6-4-10-8(5-11)7(2)9(6)12-3/h4,11H,5H2,1-3H3

Weigh it out

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

Names and synonyms

6 names

2-Pyridinemethanol, 4-methoxy-3,5-dimethyl-
2-Hydroxymethyl-4-methoxy-3,5-dimethylpyridine
2-(Hydroxymethyl)-3,5-dimethyl-4-methoxypyridine
(4-Methoxy-3,5-dimethylpyridin-2-yl)methanol
4-Methoxy-3,5-dimethyl-2-(hydroxymethyl)pyridine
3,5-Dimethyl-2-hydroxymethyl-4-methoxy-pyridine

Work with 4-Methoxy-3,5-dimethyl-2-pyridinemethanol

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-(Chloromethyl)-4-methoxy-3,5-dimethylpyridine84006-10-067 % similar 2-(Chloromethyl)-4-methoxy-3,5-dimethylpyridine hydrochloride86604-75-362 % similar 3,5-Dimethyl-4-nitro-2-pyridinemethanol149082-03-149 % similar 3,4-Dimethoxy-2-pyridinemethanol72830-08-145 % similar Omeprazole sulfide73590-85-944 % similar Tenatoprazole113712-98-443 % similar (-)-Omeprazole119141-88-741 % similar (+)-Omeprazole119141-89-841 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Azaspirodecanedione1075-89-4 1-Cyanocyclohexaneacetic acid133481-09-1 2-(2-Methoxyphenoxy)ethanamine1836-62-0 2,4-Dimethoxybenzylamine20781-20-8 2,6-Dimethoxybenzylamine20781-22-0 Ethyl 3,5-dimethyl-1H-pyrrole-2-carboxylate2199-44-2 Ethyl 2,4-dimethyl-1H-pyrrole-3-carboxylate2199-51-1 (1S,2S)-2-Amino-1-phenyl-1,3-propanediol28143-91-1

Elsewhere

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