Cas no 30866-52-5 (Benzenepropanamide,2-chloro-a-phenyl-)
30866-52-5 structure
Product Name:Benzenepropanamide,2-chloro-a-phenyl-
CAS No:30866-52-5
MF:C15H14ClNO
MW:259.730762958527
CID:322408
PubChem ID:276493
Update Time:2025-04-19
Benzenepropanamide,2-chloro-a-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzenepropanamide,2-chloro-a-phenyl-
- 3-(2-chlorophenyl)-2-phenylpropanamide
- Benzenepropanamide,2-chloro-a-phenyl
- DTXSID70298598
- NSC-124481
- NSC124481
- 30866-52-5
-
- Inchi： 1S/C15H14ClNO/c16-14-9-5-4-8-12(14)10-13(15(17)18)11-6-2-1-3-7-11/h1-9,13H,10H2,(H2,17,18)
- InChI Key： FNXKQLAQUNIYMS-UHFFFAOYSA-N
- SMILES： ClC1C=CC=CC=1CC(C(N)=O)C1C=CC=CC=1
Computed Properties
- Exact Mass: 259.07600
- Monoisotopic Mass: 259.0763918g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 18
- Rotatable Bond Count: 4
- Complexity: 276
- 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
- XLogP3: 3.4
- Topological Polar Surface Area: 43.1?2
Experimental Properties
- PSA: 43.09000
- LogP: 3.85190
Benzenepropanamide,2-chloro-a-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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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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