Cas no 111530-49-5 (4-[4-(7-oxabicyclo[4.1.0]heptan-4-ylmethoxy)butoxymethyl]-7-oxabicyclo[4.1.0]heptane)
111530-49-5 structure
Product Name:4-[4-(7-oxabicyclo[4.1.0]heptan-4-ylmethoxy)butoxymethyl]-7-oxabicyclo[4.1.0]heptane
CAS No:111530-49-5
MF:C18H30O4
MW:310.428406238556
CID:2607040
PubChem ID:21422024
Update Time:2025-04-21
4-[4-(7-oxabicyclo[4.1.0]heptan-4-ylmethoxy)butoxymethyl]-7-oxabicyclo[4.1.0]heptane Chemical and Physical Properties
Names and Identifiers
-
- 4-[4-(7-oxabicyclo[4.1.0]heptan-4-ylmethoxy)butoxymethyl]-7-oxabicyclo[4.1.0]heptane
- 3,3'-[Butane-1,4-diylbis(oxymethylene)]bis(7-oxabicyclo[4.1.0]heptane)
- 111530-49-5
- SCHEMBL11759538
- DTXSID40613577
-
- Inchi: 1S/C18H30O4/c1(7-19-11-13-3-5-15-17(9-13)21-15)2-8-20-12-14-4-6-16-18(10-14)22-16/h13-18H,1-12H2
- InChI Key: FCJFXPRMUHRGOO-UHFFFAOYSA-N
- SMILES: O1C2CCC(COCCCCOCC3CCC4C(C3)O4)CC12
Computed Properties
- Exact Mass: 310.21440943Da
- Monoisotopic Mass: 310.21440943Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 22
- Rotatable Bond Count: 9
- Complexity: 327
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 6
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.4
- Topological Polar Surface Area: 43.5?2
4-[4-(7-oxabicyclo[4.1.0]heptan-4-ylmethoxy)butoxymethyl]-7-oxabicyclo[4.1.0]heptane Related Literature
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
111530-49-5 (4-[4-(7-oxabicyclo[4.1.0]heptan-4-ylmethoxy)butoxymethyl]-7-oxabicyclo[4.1.0]heptane) Related Products
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