Cas no 16460-86-9 (1-Pentanone, 1,3-diphenyl-, (3S)-)
16460-86-9 structure
Product Name:1-Pentanone, 1,3-diphenyl-, (3S)-
CAS No:16460-86-9
MF:C17H18O
MW:238.324224948883
CID:1348649
PubChem ID:9794723
Update Time:2025-04-20
1-Pentanone, 1,3-diphenyl-, (3S)- Chemical and Physical Properties
Names and Identifiers
-
- 1-Pentanone, 1,3-diphenyl-, (3S)-
- (3S)-1,3-diphenylpentan-1-one
- 16460-86-9
- SCHEMBL12158645
- DTXSID40430807
-
- Inchi： 1S/C17H18O/c1-2-14(15-9-5-3-6-10-15)13-17(18)16-11-7-4-8-12-16/h3-12,14H,2,13H2,1H3/t14-/m0/s1
- InChI Key： KRUIOJKRONYXTA-AWEZNQCLSA-N
- SMILES： O=C(C1C=CC=CC=1)C[C@@H](C1C=CC=CC=1)CC
Computed Properties
- Exact Mass: 238.135765193g/mol
- Monoisotopic Mass: 238.135765193g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 18
- Rotatable Bond Count: 5
- Complexity: 246
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.4
- Topological Polar Surface Area: 17.1?2
1-Pentanone, 1,3-diphenyl-, (3S)- Related Literature
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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5. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
16460-86-9 (1-Pentanone, 1,3-diphenyl-, (3S)-) Related Products
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- 1083-30-3(3-Phenylpropiophenone)
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- 1671-77-8(4’-Methylvalerophenone)
- 495-40-9(N-Butyrophenone)
- 495-71-6(1,2-Dibenzoylethane)
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