2-Fluoro-4-methoxybenzoylchloride

C₈H₆ClFO₂CAS 321-24-4188.58 g/mol

Open in Covalent MOL file

Acyl halide Aryl halide Ether

Properties

Molecular formula: C₈H₆ClFO₂
Molar mass: 188.58 g/mol
Exact mass: 188.0040 Da
logP: 2.21Crippen estimate
Polar surface area: 26.3 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 2

Hazards

Danger

H314 Causes severe skin burns and eye damage100% of notifiers

Aggregated from 5 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, P501

Identifiers

CAS number

321-24-4

SMILES

COC1=CC(=C(C=C1)C(=O)Cl)F

InChIKey

UHLDNUXKNREILG-UHFFFAOYSA-N

InChI

InChI=1S/C8H6ClFO2/c1-12-5-2-3-6(8(9)11)7(10)4-5/h2-4H,1H3

Weigh it out

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

Names and synonyms

1 names

2-Fluoro-4-methoxybenzoyl chloride

Work with 2-Fluoro-4-methoxybenzoylchloride

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-Fluoro-4-methoxyacetophenone74457-86-665 % similar 2-Fluoro-4-methoxybenzoic acid394-42-363 % similar 2,5-Dimethoxybenzoyl chloride17918-14-862 % similar 2-Bromo-5-methoxybenzoyl chloride56658-04-959 % similar 2,4-Difluorobenzoyl chloride72482-64-558 % similar 4-Chloro-2-fluorobenzoyl chloride394-39-857 % similar 4-Bromo-2-fluorobenzoyl chloride151982-51-355 % similar 2,4,5-Trifluoro-3-methoxybenzoyl chloride112811-66-254 % similar

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

Same formula

2-Chloro-4-fluorobenzeneacetic acid177985-32-9 4-Chloro-2-fluorophenylacetic acid194240-75-0 2-(3-Chloro-5-fluorophenyl)acetic acid202001-00-1 3-Chloro-2-fluorobenzeneacetic acid261762-96-3 2-Chloro-6-fluoro-3-methylbenzoic acid32890-89-4 6-Chloro-2-fluoro-3-methylbenzoic acid32890-90-7 2-Chloro-6-fluorobenzeneacetic acid37777-76-7 3-Fluoro-4-methoxybenzoyl chloride3907-15-1

Elsewhere

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