3-Oxotetradecanoic Acid - CAS 88222-72-4

Catalog:	BB038788
Product Name:	3-Oxotetradecanoic Acid
CAS:	88222-72-4
Synonyms:	3-oxotetradecanoic acid; 3-oxotetradecanoic acid

Technical Data

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Computed Properties

IUPAC Name:	3-oxotetradecanoic acid
Description:	3-Oxotetradecanoic Acid (CAS# 88222-72-4 ) is a useful research chemical.
Molecular Weight:	242.35
Molecular Formula:	C14H26O3
Canonical SMILES:	CCCCCCCCCCCC(=O)CC(=O)O
InChI:	InChI=1S/C14H26O3/c1-2-3-4-5-6-7-8-9-10-11-13(15)12-14(16)17/h2-12H2,1H3,(H,16,17)
InChI Key:	XLKOZYOVXNPWGT-UHFFFAOYSA-N
Appearance:	Solid
LogP:	3.95110

Publication Number	Title	Priority Date
CN-112964807-A	Metabolism marker for prognosis of chronic acute liver failure of hepatitis B and screening method thereof	20210330
CN-109813813-A	Identify the method for ultra-high-temperature sterilized milk and reconstituted milk based on lipid group	20190118
EP-3511419-A1	Compound or salt thereof, anti-inflammatory agent, anticancer agent for lung cancer, method for producing compound or salt thereof, method for treating inflammatory disease, and method for treating lung cancer	20160923
WO-2014149024-A1	Biodegradable polyester-based blends	20130318
EP-2971021-A2	Microorganisms and methods for producing butadiene and related compounds by formate assimilation	20130315

PMID	Publication Date	Title	Journal
22581066	20120801	Development of a bioprocess to convert PET derived terephthalic acid and biodiesel derived glycerol to medium chain length polyhydroxyalkanoate	Applied microbiology and biotechnology
22451412	20120101	Overexpression of the (R)-specific enoyl-CoA hydratase gene from Pseudomonas chlororaphis HS21 in Pseudomonas strains for the biosynthesis of polyhydroxyalkanoates of altered monomer composition	Bioscience, biotechnology, and biochemistry
20605911	20100901	Enzymatic functions of wild tomato methylketone synthases 1 and 2	Plant physiology
16489492	20060201	Biosynthesis of medium-chain-length poly(hydroxyalkanoates) from soy molasses	Biotechnology letters
12759786	20031001	Effect of inactivation of poly(hydroxyalkanoates) depolymerase gene on the properties of poly(hydroxyalkanoates) in Pseudomonas resinovorans	Applied microbiology and biotechnology

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Complexity:	212
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	242.18819469
Formal Charge:	0
Heavy Atom Count:	17
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	242.18819469
Rotatable Bond Count:	12
Topological Polar Surface Area:	54.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	4.8