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20012-50-4 | Octane, 2,2'-oxybis-
CAS No: 20012-50-4 Catalog No: AG002CK7 MDL No:
Product Description
Catalog Number:
AG002CK7
Chemical Name:
Octane, 2,2'-oxybis-
CAS Number:
20012-50-4
Molecular Formula:
C16H34O
Molecular Weight:
242.4406
IUPAC Name:
2-octan-2-yloxyoctane
InChI:
InChI=1S/C16H34O/c1-5-7-9-11-13-15(3)17-16(4)14-12-10-8-6-2/h15-16H,5-14H2,1-4H3
InChI Key:
VYXCQGPAYIQVFL-UHFFFAOYSA-N
SMILES:
CCCCCCC(OC(CCCCCC)C)C
Properties
Complexity:
129
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.261g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.447g/mol
Monoisotopic Mass:
242.261g/mol
Rotatable Bond Count:
12
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
6.7
Literature
| Title | Journal |
|---|---|
| [Synthesis and anti-inflammatory activities of methylhesperetin-7-alkyl ether analogues]. | Yao xue xue bao = Acta pharmaceutica Sinica 20110701 |
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