Undecanoyl chloride

C₁₁H₂₁ClOCAS 17746-05-3204.74 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₁H₂₁ClO
Molar mass: 204.74 g/mol
Exact mass: 204.1281 Da
Boiling point: 90 °C (at 1 Torr)
logP: 4.28Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 9

Hazards

Danger

H314 Causes severe skin burns and eye damage100% of notifiers

Aggregated from 44 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

17746-05-3

SMILES

CCCCCCCCCCC(=O)Cl

InChIKey

JUKPJGZUFHCZQI-UHFFFAOYSA-N

InChI

InChI=1S/C11H21ClO/c1-2-3-4-5-6-7-8-9-10-11(12)13/h2-10H2,1H3

Weigh it out

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

Names and synonyms

4 names

n-Undecanoyl chloride
Undecanoic acid chloride
NSC 83585
Undecanoic acid, anhydride with carbonochloridic acid

Work with Undecanoyl 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

Similar compounds

Octanoyl chloride111-64-8100 % similar Decanoyl chloride112-13-0100 % similar Lauroyl chloride112-16-3100 % similar Tetradecanoyl chloride112-64-1100 % similar Palmitoyl chloride112-67-4100 % similar Stearoyl chloride112-76-5100 % similar Heptanoyl chloride2528-61-2100 % similar Nonanoyl chloride764-85-2100 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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