1-Acetylpiperidine-4-carbonyl chloride

C₈H₁₂ClNO₂CAS 59084-16-1189.64 g/mol

Open in Covalent MOL file

Acyl halide Amide

Properties

Molecular formula: C₈H₁₂ClNO₂
Molar mass: 189.64 g/mol
Exact mass: 189.0557 Da
Melting point: 130–138 °C
logP: 1.01Crippen estimate
Polar surface area: 37.4 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 1

Hazards

Danger

H314 Causes severe skin burns and eye damage100% of notifiers
H318 Causes serious eye damage14.3% of notifiers
H319 Causes serious eye irritation14.3% of notifiers
H335 May cause respiratory irritation14.3% of notifiers

Aggregated from 7 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P337+P317, P363, P403+P233, P405, P501

Identifiers

CAS number

59084-16-1

SMILES

CC(=O)N1CCC(C(=O)Cl)CC1

InChIKey

OHCPVLJEAHBMEG-UHFFFAOYSA-N

InChI

InChI=1S/C8H12ClNO2/c1-6(11)10-4-2-7(3-5-10)8(9)12/h7H,2-5H2,1H3

Weigh it out

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

Names and synonyms

6 names

1-Acetyl-4-piperidinecarbonyl chloride
4-Piperidinecarbonyl chloride, 1-acetyl-
1-Acetylisonipecotoyl chloride
1-Acetyl-4-piperidylcarbonyl chloride
N-Acetylisonipecotoyl chloride
1-Acetylpiperidin-4-ylcarbonyl chloride

Work with 1-Acetylpiperidine-4-carbonyl 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 Isotope patternExact mass and the mass spectrum pattern

Same formula

4-Deoxypyridoxine148-51-6 1-(m-Hydroxyphenyl)-2-aminoethanol hydrochloride15308-34-6 1-(m-Hydroxyphenyl)-2-aminoethanol hydrochloride4779-94-6 Dopamine hydrochloride62-31-7 3-Methoxy-4-hydroxybenzylamine hydrochloride7149-10-2 (±)-Octopamine hydrochloride770-05-8 O-(4-Methoxybenzyl)hydroxylamine hydrochloride876-33-5

Elsewhere

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