Cas no 88701-85-3 (2-Propen-1-one, 3-(2,6-dichlorophenyl)-1-(2-hydroxyphenyl)-, (2E)-)
88701-85-3 structure
Product Name:2-Propen-1-one, 3-(2,6-dichlorophenyl)-1-(2-hydroxyphenyl)-, (2E)-
CAS No:88701-85-3
MF:C15H10Cl2O2
MW:293.14470243454
CID:623951
PubChem ID:6143779
Update Time:2025-04-19
2-Propen-1-one, 3-(2,6-dichlorophenyl)-1-(2-hydroxyphenyl)-, (2E)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Propen-1-one, 3-(2,6-dichlorophenyl)-1-(2-hydroxyphenyl)-, (2E)-
- 3-(2,6-dichlorophenyl)-1-(2-hydroxyphenyl)prop-2-en-1-one
- SCHEMBL5139336
- (E)-3-(2,6-dichlorophenyl)-1-(2-hydroxyphenyl)prop-2-en-1-one
- 2,6-DICHLORO-2'-HYDROXYCHALCONE
- (2E)-3-(2,6-dichlorophenyl)-1-(2-hydroxyphenyl)-2-propen-1-one
- CHEMBL2024272
- 88701-85-3
-
- Inchi： 1S/C15H10Cl2O2/c16-12-5-3-6-13(17)10(12)8-9-15(19)11-4-1-2-7-14(11)18/h1-9,18H/b9-8+
- InChI Key： DBQYHWPRRQKNKQ-CMDGGOBGSA-N
- SMILES： ClC1C=CC=C(C=1/C=C/C(C1C=CC=CC=1O)=O)Cl
Computed Properties
- Exact Mass: 292.0057849g/mol
- Monoisotopic Mass: 292.0057849g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 19
- Rotatable Bond Count: 3
- Complexity: 333
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- XLogP3: 5.1
- Topological Polar Surface Area: 37.3?2
2-Propen-1-one, 3-(2,6-dichlorophenyl)-1-(2-hydroxyphenyl)-, (2E)- Related Literature
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R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
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Christian K. Rank,Alexander W. Jones,Tatjana Wall,Patrick Di Martino-Fumo,Sarah Schr?ck,Markus Gerhards,Frederic W. Patureau Chem. Commun., 2019,55, 13749-13752
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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Patricia A. A. M. Vaz,Jo?o Rocha,Artur M. S. Silva New J. Chem., 2016,40, 8198-8201
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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