Cas no 51307-04-1 (2,4-Pentanedione, 1,5-diphenyl-)
51307-04-1 structure
Product Name:2,4-Pentanedione, 1,5-diphenyl-
CAS No:51307-04-1
MF:C17H16O2
MW:252.307744979858
CID:362579
PubChem ID:11139621
Update Time:2025-04-19
2,4-Pentanedione, 1,5-diphenyl- Chemical and Physical Properties
Names and Identifiers
-
- 2,4-Pentanedione, 1,5-diphenyl-
- 1,5-diphenylpentane-2,4-dione
- 51307-04-1
- CHEMBL503023
- DTXSID70456696
- SCHEMBL51367
-
- Inchi： 1S/C17H16O2/c18-16(11-14-7-3-1-4-8-14)13-17(19)12-15-9-5-2-6-10-15/h1-10H,11-13H2
- InChI Key： HNFHVPDEAVTSAR-UHFFFAOYSA-N
- SMILES： O=C(CC1C=CC=CC=1)CC(CC1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 252.11508
- Monoisotopic Mass: 252.115029749g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 19
- Rotatable Bond Count: 6
- Complexity: 266
- 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: 3
- Topological Polar Surface Area: 34.1?2
Experimental Properties
- PSA: 34.14
2,4-Pentanedione, 1,5-diphenyl- Related Literature
-
M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
-
Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
-
Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
-
Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
-
Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
51307-04-1 (2,4-Pentanedione, 1,5-diphenyl-) Related Products
- 2550-26-7(4-phenylbutan-2-one)
- 1007-32-5(1-Phenyl-2-butanone)
- 3318-61-4(1-Phenylpentane-2,4-dione)
- 102-04-5(1,3-Diphenyl-2-propanone)
- 2096-86-8(4-Methylphenylacetone)
- 18328-11-5(4-Phenylbutanal)
- 29898-25-7(1-Phenyl-3-hexanone)
- 20795-51-1(1-Phenylpentan-3-one)
- 6683-92-7(1-Phenyl-2-pentanone)
- 5349-62-2(4-Methyl-1-phenyl-2-pentanone)
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