Cas no 28861-22-5 (1,7-Heptanedione, 1,7-diphenyl-)
28861-22-5 structure
Product Name:1,7-Heptanedione, 1,7-diphenyl-
CAS No:28861-22-5
MF:C19H20O2
MW:280.360905647278
CID:1436934
PubChem ID:458199
Update Time:2025-04-20
1,7-Heptanedione, 1,7-diphenyl- Chemical and Physical Properties
Names and Identifiers
-
- 1,7-Heptanedione, 1,7-diphenyl-
- 1,5-Dibenzoylpentane
- 1,7-diphenylheptane-1,7-dione
- AKOS015839066
- SCHEMBL9057671
- 1,7-Diphenyl-1,7-heptanedione
- 28861-22-5
- BEOXSPKFNAHKED-UHFFFAOYSA-N
-
- Inchi： 1S/C19H20O2/c20-18(16-10-4-1-5-11-16)14-8-3-9-15-19(21)17-12-6-2-7-13-17/h1-2,4-7,10-13H,3,8-9,14-15H2
- InChI Key： BEOXSPKFNAHKED-UHFFFAOYSA-N
- SMILES： O=C(C1C=CC=CC=1)CCCCCC(C1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 280.1464
- Monoisotopic Mass: 280.146
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 21
- Rotatable Bond Count: 8
- Complexity: 291
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.1
- Topological Polar Surface Area: 34.1?2
Experimental Properties
- PSA: 34.14
1,7-Heptanedione, 1,7-diphenyl- Related Literature
-
Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
-
Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
-
Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
-
Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
28861-22-5 (1,7-Heptanedione, 1,7-diphenyl-) Related Products
- 37920-25-5(4'-Butylacetophenone)
- 3375-38-0(1,6-Diphenyl-1,6-hexanedione)
- 120-46-7(Dibenzoylmethane)
- 1009-14-9(Valerophenone)
- 1671-77-8(4’-Methylvalerophenone)
- 27465-51-6(1-(4-Ethylphenyl)propan-1-one)
- 51772-30-6(3'-Methylpropiophenone)
- 5337-93-9(4-Methylpropiophenone)
- 495-40-9(N-Butyrophenone)
- 495-71-6(1,2-Dibenzoylethane)
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