2-(6-Bromo-3-pyridyl)-2-propanol

C₈H₁₀BrNOCAS 477252-29-2216.08 g/mol

Open in Covalent MOL file

Alcohol Aryl halide

Properties

Molecular formula: C₈H₁₀BrNO
Molar mass: 216.08 g/mol
Exact mass: 214.9946 Da
logP: 2.07Crippen estimate
Polar surface area: 33.1 Å²
H-bond donors / acceptors: 1 / 2
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

477252-29-2

SMILES

CC(C)(O)c1ccc(Br)nc1

InChIKey

QXXFENKOGOCHSU-UHFFFAOYSA-N

InChI

InChI=1S/C8H10BrNO/c1-8(2,11)6-3-4-7(9)10-5-6/h3-5,11H,1-2H3

Weigh it out

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

Names and synonyms

5 names

6-Bromo-α,α-dimethyl-3-pyridinemethanol
3-Pyridinemethanol, 6-bromo-α,α-dimethyl-
2-Bromo-5-(1-hydroxy-1-methylethyl)pyridine
2-(6-Bromopyridin-3-yl)propan-2-ol
2-(6-Bromo-3-pyridyl)propan-2-ol

Work with 2-(6-Bromo-3-pyridyl)-2-propanol

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-(6-Aminopyridin-3-yl)propan-2-ol843643-03-858 % similar 2-Bromo-5-(trifluoromethyl)pyridine50488-42-153 % similar α1,α1,α4,α4-Tetramethyl-1,4-benzenedimethanol2948-46-152 % similar 2-(4-Bromophenyl)propan-2-ol2077-19-252 % similar 2-Bromo-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine214360-62-045 % similar 2-Bromo-5-methylpyridine3510-66-544 % similar 2-Bromo-5-hydroxypyridine55717-40-344 % similar 2-Bromo-5-hydroxypyridine55717-45-844 % similar

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

Same formula

4-Bromo-3-ethoxybenzenamine125756-95-8 1-(2-Oxopropyl)pyridinium bromide17282-41-6 2-(6-Bromopyridin-2-yl)propan-2-ol638218-78-7 3-Bromo-2-isopropoxypyridine717843-55-5 5-Bromo-2-(1-methylethoxy)pyridine870521-31-6

Elsewhere

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