2-Chloro-4-iodopyridine-3-methanol

C₆H₅ClINOCAS 884494-44-4269.47 g/mol

Open in Covalent MOL file

Alcohol Aryl halide

Properties

Molecular formula: C₆H₅ClINO
Molar mass: 269.47 g/mol
Exact mass: 268.9104 Da
logP: 1.83Crippen estimate
Polar surface area: 33.1 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Hazards

Danger

H302 Harmful if swallowed90.5% of notifiers
H315 Causes skin irritation100% of notifiers
H318 Causes serious eye damage90.5% of notifiers
H335 May cause respiratory irritation100% 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+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

884494-44-4

SMILES

C1=CN=C(C(=C1I)CO)Cl

InChIKey

BZQRQPAKTCMYIA-UHFFFAOYSA-N

InChI

InChI=1S/C6H5ClINO/c7-6-4(3-10)5(8)1-2-9-6/h1-2,10H,3H2

Weigh it out

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

Names and synonyms

1 names

(2-Chloro-4-iodopyridin-3-yl)methanol

Work with 2-Chloro-4-iodopyridine-3-methanol

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-Chloro-3-fluoro-4-iodopyridine148639-07-050 % similar 2-Chloro-4-iodo-3-methylpyridine153034-88-950 % similar 2-Chloro-4-iodonicotinonitrile1171919-75-746 % similar 2-Chloro-4-iodopyridine-3-carbaldehyde153034-90-346 % similar 2-Chloro-3-pyridinemethanol42330-59-646 % similar 2-Chloro-3-iodopyridine78607-36-045 % similar (3-Chloropyrazin-2-yl)methanol89283-32-945 % similar 2,4-Dichloro-3-iodopyridine343781-36-240 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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