2-Ethoxyacetyl chloride

C₄H₇ClO₂CAS 14077-58-8122.55 g/mol

Open in Covalent MOL file

Acyl halide Ether

Properties

Molecular formula: C₄H₇ClO₂
Molar mass: 122.55 g/mol
Exact mass: 122.0135 Da
Boiling point: 125 °C
logP: 0.79Crippen estimate
Polar surface area: 26.3 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 3

Hazards

Danger

H226 Flammable liquid and vapor100% of notifiers
H290 May be corrosive to metals16.7% of notifiers
H314 Causes severe skin burns and eye damage100% of notifiers
H318 Causes serious eye damage16.7% of notifiers
H332 Harmful if inhaled83.3% of notifiers

Aggregated from 6 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P234, P240, P241, P242, P243, P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P363, P370+P378, P390, P403+P235, P405, P406, P501

Identifiers

CAS number

14077-58-8

SMILES

CCOCC(=O)Cl

InChIKey

ZPMWWAIBJJFPPQ-UHFFFAOYSA-N

InChI

InChI=1S/C4H7ClO2/c1-2-7-3-4(5)6/h2-3H2,1H3

Weigh it out

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

Names and synonyms

5 names

Acetyl chloride, 2-ethoxy-
Acetyl chloride, ethoxy-
Ethoxyacetyl chloride
α-Ethoxyacetyl chloride
Ethoxyacetic acid chloride

Work with 2-Ethoxyacetyl chloride

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Methoxyacetyl chloride38870-89-252 % similar Ethyl 3-chloro-3-oxopropanoate36239-09-548 % similar Ethoxyacetic acid627-03-248 % similar Ethyl ethoxyacetate817-95-848 % similar Ethyl succinyl chloride14794-31-147 % similar 2-(Acetyloxy)acetyl chloride13831-31-746 % similar Propionyl chloride79-03-846 % similar Ethyl 4-(chloroformyl)butyrate5205-39-045 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Ethyl chloroacetate105-39-5 Isopropyl chloroformate108-23-6 Propyl chloroformate109-61-5 Methyl 2-chloropropionate17639-93-9 2-(Chloromethyl)-1,3-dioxolane2568-30-1 (S)-2-Chloro-N-butyric acid32653-32-0 2-Chlorobutanoic acid4170-24-5 4-Chlorobutanoic acid627-00-9

Elsewhere

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