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114019-70-4 | Undecanoic acid, 11-(ethylthio)-
CAS No: 114019-70-4 Catalog No: AG000AB6 MDL No:
Product Description
Catalog Number:
AG000AB6
Chemical Name:
Undecanoic acid, 11-(ethylthio)-
CAS Number:
114019-70-4
Molecular Formula:
C13H26O2S
Molecular Weight:
246.4093
IUPAC Name:
11-ethylsulfanylundecanoic acid
InChI:
InChI=1S/C13H26O2S/c1-2-16-12-10-8-6-4-3-5-7-9-11-13(14)15/h2-12H2,1H3,(H,14,15)
InChI Key:
YDNFLXXNJDMLOT-UHFFFAOYSA-N
SMILES:
CCSCCCCCCCCCCC(=O)O
UNII:
UN1Q7W20V8
NSC Number:
665968
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.165g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
246.409g/mol
Monoisotopic Mass:
246.165g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
Literature
| Title | Journal |
|---|---|
| In vitro antiviral activities of myristic acid analogs against human immunodeficiency and hepatitis B viruses. | Antiviral research 19970501 |
| Replication of human immunodeficiency virus 1 and Moloney murine leukemia virus is inhibited by different heteroatom-containing analogs of myristic acid. | Proceedings of the National Academy of Sciences of the United States of America 19891101 |
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