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75853-49-5

75853-49-5 Structure

75853-49-5 Structure
IdentificationBack Directory
[Name]

12-Methyltridecanal
[CAS]

75853-49-5
[Synonyms]

12-Methyltridecanal
10%Solutioninmigliol
Tridecanal, 12-methyl-
12-methyl-1-tridecanal
12-methyl tridecaldehyde
12-Methyltridecanal USP/EP/BP
12-methyltridecanal,12-methyltridecanal
[EINECS(EC#)]

203-706-9
[Molecular Formula]

C14H28O
[MDL Number]

MFCD10000650
[MOL File]

75853-49-5.mol
[Molecular Weight]

212.37
Chemical PropertiesBack Directory
[Melting point ]

25°C (estimate)
[Boiling point ]

282.23°C (estimate)
[density ]

0.8321 (estimate)
[FEMA ]

4005 | 12-METHYLTRIDECANAL
[refractive index ]

1.4385 (estimate)
[storage temp. ]

Inert atmosphere,Store in freezer, under -20°C
[solubility ]

Chloroform (Slightly), Methanol (Slightly)
[form ]

Oil
[color ]

Colourless
[Odor]

at 1.00 % in propylene glycol. cooked meat tallow fat meat broth sweat fruity waxy citrus
[Odor Type]

meaty
[JECFA Number]

1229
[InChI]

InChI=1S/C14H28O/c1-14(2)12-10-8-6-4-3-5-7-9-11-13-15/h13-14H,3-12H2,1-2H3
[InChIKey]

OQWNKUAZQSLNSR-UHFFFAOYSA-N
[SMILES]

C(=O)CCCCCCCCCCC(C)C
[LogP]

6.04
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319
[Precautionary statements ]

P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
[HS Code ]

2912.19.5000
Hazard InformationBack Directory
[Description]

12-Methyltridecanal, also known as 12-MT aldehyde or isotetradecan-1-al, belongs to the class of organic compounds known as fatty aldehydes. These are long chain aldehydes with a chain of at least 12 carbon atoms. Thus, 12-methyltridecanal is considered to be a fatty aldehyde lipid molecule. 12-Methyltridecanal is considered to be a practically insoluble (in water) and relatively neutral molecule. 12-Methyltridecanal has been primarily detected in urine. Within the cell, 12-methyltridecanal is primarily located in the membrane (predicted from logP) and cytoplasm. 12-Methyltridecanal has a broth, cooked, and cooked meat taste.
[Chemical Properties]

12-Methyltridecanal has an aroma characteristic of stewed beef (meaty, tallow)
[Occurrence]

Stated to be of natural origin; has not been reported in any food items by TNO (Nutrition and Food Research) (TNO, 2000)
[Uses]

12-Methyltridecanal (MT) was found in microorganisms samples isolated from beef.
[Application]

12-Methyltridecanal can be used in the field of analytical chemistry as a standard for the calibration of detection instruments, such as gas chromatography-mass spectrometry (GC-MS), aimed at identifying and quantifying volatile compounds within complex mixtures. Its role in the synthesis of surface-active agents is another area of application, contributing to research on substances that alter the surface tension of liquids.
[Biosynthesis]

It is believed that 12-methyltridecanal is preferentially a constituent of ruminants, possibly being synthesized by the bacteria in the rumen, andincorporated in the plasmalogens.
[Aroma threshold values]

Detection at 0.0001 ppm (water)
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