Cas no 89572-41-8 (2-Propen-1-one, 3-(3,4-dimethylphenyl)-1-phenyl-)
89572-41-8 structure
Product Name:2-Propen-1-one, 3-(3,4-dimethylphenyl)-1-phenyl-
CAS No:89572-41-8
MF:C17H16O
MW:236.308344841003
CID:595982
PubChem ID:57034654
Update Time:2025-04-19
2-Propen-1-one, 3-(3,4-dimethylphenyl)-1-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- 2-Propen-1-one, 3-(3,4-dimethylphenyl)-1-phenyl-
- 3-(3,4-dimethylphenyl)-1-phenylprop-2-en-1-one
- DTXSID30720123
- 89572-41-8
- AKOS017231823
-
- Inchi： 1S/C17H16O/c1-13-8-9-15(12-14(13)2)10-11-17(18)16-6-4-3-5-7-16/h3-12H,1-2H3
- InChI Key： JYWIBILAXURLCA-UHFFFAOYSA-N
- SMILES： O=C(C1C=CC=CC=1)C=CC1C=CC(C)=C(C)C=1
Computed Properties
- Exact Mass: 236.120115130g/mol
- Monoisotopic Mass: 236.120115130g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 18
- Rotatable Bond Count: 3
- Complexity: 299
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 4.4
- Topological Polar Surface Area: 17.1?2
2-Propen-1-one, 3-(3,4-dimethylphenyl)-1-phenyl- Related Literature
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1. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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