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12-Methyltridecanal

CAS No.:
75853-49-5
Catalog Number:
AG008P5S
Molecular Formula:
C14H28O
Molecular Weight:
212.3715
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
~85%(GC)
In Stock USA
United States
$86
- +
5g
~85%(GC)
In Stock USA
United States
$286
- +
Product Description
Catalog Number:
AG008P5S
Chemical Name:
12-Methyltridecanal
CAS Number:
75853-49-5
Molecular Formula:
C14H28O
Molecular Weight:
212.3715
MDL Number:
MFCD10000650
IUPAC Name:
12-methyltridecanal
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
InChI Key:
OQWNKUAZQSLNSR-UHFFFAOYSA-N
SMILES:
O=CCCCCCCCCCCC(C)C
UNII:
T2RF910W7E
FEMA Number:
4005
Properties
Complexity:
129  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.214g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.377g/mol
Monoisotopic Mass:
212.214g/mol
Rotatable Bond Count:
11  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7  
Literature
Title Journal
Evaluation of the key aroma compounds in beef and pork vegetable gravies a la chef by stable isotope dilution assays and aroma recombination experiments. Journal of agricultural and food chemistry 20111228
Characterization of the key aroma compounds in beef and pork vegetable gravies á la chef by application of the aroma extract dilution analysis. Journal of agricultural and food chemistry 20091014
Biodiversity of sphingoid bases ('sphingosines') and related amino alcohols. Journal of lipid research 20080801
Analysis of fatty aldehyde composition, including 12-methyltridecanal, in plasmalogens from longissimus muscle of concentrate- and pasture-fed bulls. Journal of agricultural and food chemistry 20060111
The first total synthesis of the marine fatty acid (+/-)-2-methoxy-13-methyltetradecanoic acid: a cytotoxic fatty acid to leukemia cells. Chemistry and physics of lipids 20031201
Properties