Cas no 136471-67-5 (1-bromo-3-chlorooxanthrene)
1-bromo-3-chlorooxanthrene structure
Product Name:1-bromo-3-chlorooxanthrene
CAS No:136471-67-5
MF:C12H6BrClO2
MW:297.531841754913
CID:1240699
PubChem ID:178330
Update Time:2025-04-20
1-bromo-3-chlorooxanthrene Chemical and Physical Properties
Names and Identifiers
-
- 1-bromo-3-chlorooxanthrene
- 1-bromo-3-chlorodibenzo-p-dioxin
- BSEWBOMWLZBKQD-UHFFFAOYSA-N
- DTXSID00159805
- 1-bromo, 3-chloro-dibenzo-dioxin
- 136471-67-5
- Dibenzo-p-dioxin, 1-bromo-3-chloro-
-
- Inchi： 1S/C12H6BrClO2/c13-8-5-7(14)6-11-12(8)16-10-4-2-1-3-9(10)15-11/h1-6H
- InChI Key： BSEWBOMWLZBKQD-UHFFFAOYSA-N
- SMILES： BrC1=CC(=CC2=C1OC1C=CC=CC=1O2)Cl
Computed Properties
- Exact Mass: 295.92398
- Monoisotopic Mass: 295.924
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 0
- Complexity: 263
- 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: 4.4
- Topological Polar Surface Area: 18.5?2
Experimental Properties
- Density: 1.687
- Boiling Point: 362.7°C at 760 mmHg
- Flash Point: 173.2°C
- Refractive Index: 1.658
- PSA: 18.46
1-bromo-3-chlorooxanthrene Related Literature
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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Jonas Kind,Lukas Kaltschnee,Martin Leyendecker,Christina M. Thiele Chem. Commun., 2016,52, 12506-12509
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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