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112-54-9

112-54-9 structural image
Product Name: Dodecyl aldehyde
Formula: C12H24O
Synonyms: Dodecanal;Dodecyl aldehyde;Laurinaldehyde;Lauraldehyde;Lauric aldehyde
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Liquid
Boiling Point 185.00 °C. @ 100.00 mm Hg
Melting Point 44.5 °C
Solubility soluble in alcohol, most fixed oils, propylene glycol (may be turbid); insoluble in glycerol, water
Density 0.826-0.836
Vapor Pressure 0.01 [mmHg]
Refractive Index 1.433-1.439
Kovats Retention Index 1386 1388 1389 1386 1390 1387 1388 1388 1408 1389 1387 1395 1385 1388 1388 1389 1389 1396 1390 1375 1387 1388 1367 1388 1397 1387 1395 1395 1390.1 1392 1388 1388 1371.4 1387 1383 1388 1389 1389 1395 1395 1389 1390 1389 1390 1397 1397 1384 1386 1386 1405 1407 1391 1393 1384 1392 1393 1398 1397 1387 1388 1387 1388 1389 1402 1375 1388 1391 1389 1383 1387 1388 1387 1392 1387 1392 1389 1391 1391 1390 1391 1379 1385 1394 1388 1391 1386.3
Chemical Classes Other Classes -> Aldehydes

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07

Environment
GHS09
GHS Hazard Statements H315:Skin corrosion/irritation
H317:Sensitisation, Skin
H319:Serious eye damage/eye irritation
H411:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P273:Avoid release to the environment.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:IF ON SKIN: wash with plenty of soap and water.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

COMPUTED DESCRIPTORS

Molecular Weight 184.32 g/mol
XLogP3 4.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 10
Exact Mass 184.182715385 g/mol
Monoisotopic Mass 184.182715385 g/mol
Topological Polar Surface Area 17.1 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 99.3
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Dodecanal is a long-chain fatty aldehyde that is dodecane in which two hydrogens attached to a terminal carbon are replaced by an oxo group. It has a role as a plant metabolite. It is a 2,3-saturated fatty aldehyde, a medium-chain fatty aldehyde and a long-chain fatty aldehyde. It derives from a hydride of a dodecane.

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