Cas no 6452-49-9 (Benzene,1-chloro-3-phenoxy-)
Benzene,1-chloro-3-phenoxy- structure
Product Name:Benzene,1-chloro-3-phenoxy-
Benzene,1-chloro-3-phenoxy- Chemical and Physical Properties
Names and Identifiers
-
- Benzene,1-chloro-3-phenoxy-
- 1-Chloro-3-phenoxybenzene
- AC1L3RZQ
- AC1Q3QTE
- BMURONZFJJPAOK-UHFFFAOYSA-
- CTK5C1366
- Ether, m-chlorophenyl phenyl
- SureCN3790523
-
- Inchi： 1S/C12H9ClO/c13-10-5-4-8-12(9-10)14-11-6-2-1-3-7-11/h1-9H
- InChI Key： BMURONZFJJPAOK-UHFFFAOYSA-N
- SMILES： ClC1=CC=CC(=C1)OC1C=CC=CC=1
Computed Properties
- Exact Mass: 204.03427
- Monoisotopic Mass: 204.034193
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 166
- 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: 4.5
- Topological Polar Surface Area: 9.2
Experimental Properties
- Density: 1.19
- Boiling Point: 284.4°C at 760 mmHg
- Flash Point: 128.4°C
- Refractive Index: 1.584
- PSA: 9.23
Benzene,1-chloro-3-phenoxy- Related Literature
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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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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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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