Cas no 88068-13-7 (3,8-Decanedione, 1-phenyl-)
3,8-Decanedione, 1-phenyl- structure
Product Name:3,8-Decanedione, 1-phenyl-
CAS No:88068-13-7
MF:C16H22O2
MW:246.344685077667
CID:646505
PubChem ID:13139208
Update Time:2025-04-19
3,8-Decanedione, 1-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- 3,8-Decanedione, 1-phenyl-
- 1-phenyldecane-3,8-dione
- DTXSID70521075
- 88068-13-7
-
- Inchi： 1S/C16H22O2/c1-2-15(17)10-6-7-11-16(18)13-12-14-8-4-3-5-9-14/h3-5,8-9H,2,6-7,10-13H2,1H3
- InChI Key： ARZHKFUKBGOYCZ-UHFFFAOYSA-N
- SMILES： O=C(CCC1C=CC=CC=1)CCCCC(CC)=O
Computed Properties
- Exact Mass: 246.161979940g/mol
- Monoisotopic Mass: 246.161979940g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 9
- Complexity: 252
- 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: 2.6
- Topological Polar Surface Area: 34.1?2
3,8-Decanedione, 1-phenyl- Related Literature
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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Chen Long,Ying Dai,Jianwei Li,Hao Jin Nanoscale, 2020,12, 21124-21130
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
-
Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
88068-13-7 (3,8-Decanedione, 1-phenyl-) 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)
- 25870-62-6(1-Phenyl-2-hexanone)
- 104-53-0(3-Phenylpropanal)
- 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)
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