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Benzenedecanoic acid

CAS No.:
18017-73-7
Catalog Number:
AG0021RL
Molecular Formula:
C16H24O2
Molecular Weight:
248.3606
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Product Description
Catalog Number:
AG0021RL
Chemical Name:
Benzenedecanoic acid
CAS Number:
18017-73-7
Molecular Formula:
C16H24O2
Molecular Weight:
248.3606
MDL Number:
MFCD00037804
IUPAC Name:
10-phenyldecanoic acid
InChI:
InChI=1S/C16H24O2/c17-16(18)14-10-5-3-1-2-4-7-11-15-12-8-6-9-13-15/h6,8-9,12-13H,1-5,7,10-11,14H2,(H,17,18)
InChI Key:
IISIYJPTBDSIFM-UHFFFAOYSA-N
SMILES:
OC(=O)CCCCCCCCCc1ccccc1
Properties
Complexity:
207  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.178g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
248.366g/mol
Monoisotopic Mass:
248.178g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2  
Literature
Title Journal
Facile and rapid access to linear and truncated microcystin analogues for the implementation of immunoassays. Organic & biomolecular chemistry 20100207
Biosynthesis of storage compounds by Rhodococcus jostii RHA1 and global identification of genes involved in their metabolism. BMC genomics 20080101
Triacylglycerols in prokaryotic microorganisms. Applied microbiology and biotechnology 20021201
Identification of phenyldecanoic acid as a constituent of triacylglycerols and wax ester produced by Rhodococcus opacus PD630. Microbiology (Reading, England) 20020501
In vitro antiviral activities of myristic acid analogs against human immunodeficiency and hepatitis B viruses. Antiviral research 19970501
Properties