2-chloromethylThiophene

C₅H₅ClSCAS 765-50-4132.60 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₅H₅ClS
Molar mass: 132.60 g/mol
Exact mass: 131.9800 Da
Boiling point: 80–81 °C (at 18 Torr)
logP: 2.49Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 1

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H312 Harmful in contact with skin100% of notifiers
H332 Harmful if inhaled100% of notifiers

Aggregated from 14 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, P501

Identifiers

CAS number

765-50-4

SMILES

ClCc1cccs1

InChIKey

FUOHKPSBGLXIRL-UHFFFAOYSA-N

InChI

InChI=1S/C5H5ClS/c6-4-5-2-1-3-7-5/h1-3H,4H2

Weigh it out

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

Names and synonyms

6 names

2-(Chloromethyl)thiophene
Thiophene, 2-(chloromethyl)-
Thenyl chloride
2-Thenyl chloride
2-Thienylmethyl chloride
2-Thiophenemethyl chloride

Reactions

2-CHLOROMETHYLTHIOPHENE (Thiophene, 2-chloromethyl-)product

Work with 2-chloromethylThiophene

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-Thiophenemethanamine27757-85-352 % similar 2-Thiophenemethanethiol6258-63-552 % similar 2-Thiophenemethanol636-72-652 % similar 2-Ethylthiophene872-55-952 % similar 2-Propylthiophene1551-27-548 % similar Thiopheneethanamine30433-91-148 % similar 2-Thiopheneethanol5402-55-148 % similar 2-Thiopheneacetyl chloride39098-97-047 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Chloro-3-methylthiophene14345-97-2 2-Chloro-5-methylthiophene17249-82-0

Elsewhere

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