Cas no 68519-97-1 (Pyrene,1,4,6-tribromo-)
Pyrene,1,4,6-tribromo- structure
Product Name:Pyrene,1,4,6-tribromo-
CAS No:68519-97-1
MF:C16H7Br3
MW:438.9387819767
CID:528449
PubChem ID:3017864
Update Time:2025-04-19
Pyrene,1,4,6-tribromo- Chemical and Physical Properties
Names and Identifiers
-
- Pyrene,1,4,6-tribromo-
- 1,4,6-Tribromopyrene
- NS00061403
- DTXSID90988186
- EINECS 271-194-4
- 68519-97-1
-
- Inchi： 1S/C16H7Br3/c17-12-6-4-10-14(19)7-11-13(18)5-2-8-1-3-9(12)16(10)15(8)11/h1-7H
- InChI Key： RHRFBPAWKHCKFW-UHFFFAOYSA-N
- SMILES： BrC1C=C2C(=CC=C3C=CC4=C(C=CC=1C4=C23)Br)Br
Computed Properties
- Exact Mass: 435.80971
- Monoisotopic Mass: 435.80979g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 19
- Rotatable Bond Count: 0
- Complexity: 358
- 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: 7.1
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0
Pyrene,1,4,6-tribromo- Related Literature
-
Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
-
Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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