Cas no 473580-39-1 (1-Bromo-3-((3-chlorophenyl)ethynyl)benzene)
473580-39-1 structure
Product Name:1-Bromo-3-((3-chlorophenyl)ethynyl)benzene
CAS No:473580-39-1
MF:C14H8BrCl
MW:291.570322036743
CID:2644835
PubChem ID:101206657
Update Time:2025-04-21
1-Bromo-3-((3-chlorophenyl)ethynyl)benzene Chemical and Physical Properties
Names and Identifiers
-
- HS-5790
- 1-Bromo-3-((3-chlorophenyl)ethynyl)benzene
- 1-[2-(3-bromophenyl)ethynyl]-3-chlorobenzene
- 473580-39-1
- 1-(3-Bromophenyl)-2-(3-chlorophenyl)ethyne
-
- Inchi： 1S/C14H8BrCl/c15-13-5-1-3-11(9-13)7-8-12-4-2-6-14(16)10-12/h1-6,9-10H
- InChI Key： ZDWDRGGWBTWMGI-UHFFFAOYSA-N
- SMILES： BrC1=CC=CC(C#CC2C=CC=C(C=2)Cl)=C1
Computed Properties
- Exact Mass: 289.94979Da
- Monoisotopic Mass: 289.94979Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 288
- 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: 5.3
- Topological Polar Surface Area: 0?2
1-Bromo-3-((3-chlorophenyl)ethynyl)benzene Related Literature
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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3. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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