(5-Chlorothiophen-2-yl)methanol

C₅H₅ClOSCAS 74168-69-7148.60 g/mol

Open in Covalent MOL file

Alcohol Aryl halide

Properties

Molecular formula: C₅H₅ClOS
Molar mass: 148.60 g/mol
Exact mass: 147.9750 Da
logP: 1.89Crippen estimate
Polar surface area: 20.2 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

74168-69-7

SMILES

C1=C(SC(=C1)Cl)CO

InChIKey

WMKPGPCVKFXIHD-UHFFFAOYSA-N

InChI

InChI=1S/C5H5ClOS/c6-5-2-1-4(3-7)8-5/h1-2,7H,3H2

Weigh it out

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

Names and synonyms

1 names

5-Chlorothiophene-2-ylmethanol

Work with (5-Chlorothiophen-2-yl)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-5-(chloromethyl)thiophene23784-96-558 % similar 2,5-Dichlorothiophene173777-89-450 % similar 2,5-Dichlorothiophene3172-52-950 % similar 5-Bromo-2-thiophenemethanol79387-71-650 % similar 2,5-Bis(5-hydroxymethyl-2-thienyl)furan213261-59-745 % similar 5-Chloro-2-thiophenecarboxylic acid24065-33-641 % similar 5-Chlorothiophene-2-boronic acid162607-18-340 % similar 2-Chloro-5-methylthiophene17249-82-039 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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