Cas no 2520-57-2 (Bis(4-methyl-3-pentenyl) ketone)
2520-57-2 structure
Product Name:Bis(4-methyl-3-pentenyl) ketone
CAS No:2520-57-2
MF:C13H22O
MW:194.313184261322
CID:2655644
Update Time:2023-08-06
Bis(4-methyl-3-pentenyl) ketone Chemical and Physical Properties
Names and Identifiers
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- Bis(4-methyl-3-pentenyl) ketone
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- Inchi： 1S/C13H22O/c1-11(2)7-5-9-13(14)10-6-8-12(3)4/h7-8H,5-6,9-10H2,1-4H3
- InChI Key： LTJOXDFGIGRGCK-UHFFFAOYSA-N
- SMILES： O=C(CC/C=C(\C)/C)CC/C=C(\C)/C
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 6
- Complexity: 202
- Topological Polar Surface Area: 17.1
Bis(4-methyl-3-pentenyl) ketone Related Literature
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Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
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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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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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