Cas no 53874-68-3 (Benzene,1-(dichloromethyl)-3-phenoxy-)
53874-68-3 structure
Product Name:Benzene,1-(dichloromethyl)-3-phenoxy-
CAS No:53874-68-3
MF:C13H10Cl2O
MW:253.123901844025
CID:368663
PubChem ID:104631
Update Time:2025-04-19
Benzene,1-(dichloromethyl)-3-phenoxy- Chemical and Physical Properties
Names and Identifiers
-
- Benzene,1-(dichloromethyl)-3-phenoxy-
- 1-(dichloromethyl)-3-phenoxybenzene
- 3-Phenoxybenzal chloride
- BRN 1966430
- m-Phenoxybenzal chloride
- DTXSID60202129
- EINECS 258-833-2
- 53874-68-3
- SY330903
- MFCD01657121
- NS00032863
- SCHEMBL9774306
- JOVSDWRNVGOQNK-UHFFFAOYSA-N
- Benzene, 1-(dichloromethyl)-3-phenoxy-
-
- Inchi： 1S/C13H10Cl2O/c14-13(15)10-5-4-8-12(9-10)16-11-6-2-1-3-7-11/h1-9,13H
- InChI Key： JOVSDWRNVGOQNK-UHFFFAOYSA-N
- SMILES： ClC(C1C=CC=C(C=1)OC1C=CC=CC=1)Cl
Computed Properties
- Exact Mass: 252.011
- Monoisotopic Mass: 252.011
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 202
- 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?2
Experimental Properties
- Density: 1.266
- Boiling Point: 337.2°Cat760mmHg
- Flash Point: 110.3°C
- Refractive Index: 1.588
- PSA: 9.23
Benzene,1-(dichloromethyl)-3-phenoxy- Related Literature
-
Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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