Cas no 97534-03-7 (Benzene,1,2,3,5-tetrachloro-4-(3,5-dichloro-2-methoxyphenoxy)-)
97534-03-7 structure
Product Name:Benzene,1,2,3,5-tetrachloro-4-(3,5-dichloro-2-methoxyphenoxy)-
CAS No:97534-03-7
MF:C13H6Cl6O2
MW:406.903538227081
CID:813020
PubChem ID:176637
Update Time:2025-04-19
Benzene,1,2,3,5-tetrachloro-4-(3,5-dichloro-2-methoxyphenoxy)- Chemical and Physical Properties
Names and Identifiers
-
- Benzene,1,2,3,5-tetrachloro-4-(3,5-dichloro-2-methoxyphenoxy)-
- 1,2,3,5-tetrachloro-4-(3,5-dichloro-2-methoxyphenoxy)benzene
- DTXSID20243018
- 97534-03-7
- Benzene, 1,2,3,5-tetrachloro-4-(3,5-dichloro-2-methoxyphenoxy)-
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- Inchi： 1S/C13H6Cl6O2/c1-20-12-7(16)2-5(14)3-9(12)21-13-8(17)4-6(15)10(18)11(13)19/h2-4H,1H3
- InChI Key： OJVUYBUXDZVEEG-UHFFFAOYSA-N
- SMILES： ClC1C(=C(C=C(C=1OC1C=C(C=C(C=1OC)Cl)Cl)Cl)Cl)Cl
Computed Properties
- Exact Mass: 405.847
- Monoisotopic Mass: 403.85
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 21
- Rotatable Bond Count: 3
- Complexity: 347
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 7.2
- Topological Polar Surface Area: 18.5?2
Experimental Properties
- Density: 1.591
- Boiling Point: 419°C at 760 mmHg
- Flash Point: 143.3°C
- Refractive Index: 1.61
Benzene,1,2,3,5-tetrachloro-4-(3,5-dichloro-2-methoxyphenoxy)- Related Literature
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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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Somenath Panda,Kaushik Kundu,Anusha Basaiahgari,Sanjib Senapati,Ramesh L. Gardas New J. Chem., 2018,42, 7105-7118
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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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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