2-Dodecanone

C₁₂H₂₄OCAS 6175-49-1184.32 g/mol

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Properties

Molecular formula: C₁₂H₂₄O
Molar mass: 184.32 g/mol
Exact mass: 184.1827 Da
Melting point: 21 °C
Boiling point: 246.5 °C
logP: 4.11Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 9

Hazards

H411 Toxic to aquatic life with long lasting effects97.6% of notifiers

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P273, P391, P501

Identifiers

CAS number

6175-49-1

SMILES

CCCCCCCCCCC(C)=O

InChIKey

LSKONYYRONEBKA-UHFFFAOYSA-N

InChI

InChI=1S/C12H24O/c1-3-4-5-6-7-8-9-10-11-12(2)13/h3-11H2,1-2H3

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

Names and synonyms

2 names

Methyl decyl ketone
Decyl methyl ketone

Work with 2-Dodecanone

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

2-Octanone111-13-7100 % similar 2-Undecanone112-12-9100 % similar 2-Tetradecanone2345-27-9100 % similar 2-Pentadecanone2345-28-0100 % similar 2-Tridecanone593-08-8100 % similar 2-Nonadecanone629-66-3100 % similar 2-Decanone693-54-9100 % similar 2-Nonanone821-55-6100 % similar

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

Same formula

2-Methylundecanal110-41-8 Dodecanal112-54-9 2,6,8-Trimethyl-4-nonanone123-18-2 Dodecan-3-one1534-27-6 Cyclododecanol1724-39-6 5-Dodecanone19780-10-0 1,2-Epoxydodecane2855-19-8

Elsewhere

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