Cas no 103392-12-7 (5-methyl-3-phenylhexan-2-one)
5-methyl-3-phenylhexan-2-one structure
Product Name:5-methyl-3-phenylhexan-2-one
CAS No:103392-12-7
MF:C13H18O
MW:190.281424045563
CID:1137202
PubChem ID:13156512
Update Time:2025-04-20
5-methyl-3-phenylhexan-2-one Chemical and Physical Properties
Names and Identifiers
-
- 5-methyl-3-phenylhexan-2-one
- SureCN2120942
- 2-Hexanone, 5-methyl-3-phenyl-
- 5-methyl-3-phenyl-2-hexanone
- 5-Methyl-3-phenyl-hexan-2-on
- CTK0D8581
- AGN-PC-00L72C
- ACMC-20m68p
- 5-methyl-3-phenyl-hexan-2-one
- AKOS015814474
- SureCN2120942; 2-Hexanone, 5-methyl-3-phenyl-; 5-methyl-3-phenyl-2-hexanone; 5-Methyl-3-phenyl-2-hexanone; 5-Methyl-3-phenyl-hexan-2-on; CTK0D8581; AGN-PC-00L72C; ACMC-20m68p; 5-methyl-3-phenyl-hexan-2-one; AKOS015814474;
- DTXSID70522901
- ZKEQCFAVZIDBCV-UHFFFAOYSA-N
- SCHEMBL2120942
- C5-Methyl-3-phenyl-2-hexanone
- 103392-12-7
- DA-16102
-
- Inchi： 1S/C13H18O/c1-10(2)9-13(11(3)14)12-7-5-4-6-8-12/h4-8,10,13H,9H2,1-3H3
- InChI Key： ZKEQCFAVZIDBCV-UHFFFAOYSA-N
- SMILES： O=C(C)C(C1C=CC=CC=1)CC(C)C
Computed Properties
- Exact Mass: 190.135765g/mol
- Monoisotopic Mass: 190.135765g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 4
- Complexity: 178
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Molecular Weight: 190.28g/mol
- XLogP3: 3.3
- Topological Polar Surface Area: 17.1?2
5-methyl-3-phenylhexan-2-one Related Literature
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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Eunju Nam,Jiyeon Han,Sunhee Choi,Mi Hee Lim Chem. Commun., 2021,57, 7637-7640
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
103392-12-7 (5-methyl-3-phenylhexan-2-one) Related Products
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