Cas no 63249-12-7 (Benzene, pentachloro(2-methyl-2-propenyl)-)
63249-12-7 structure
Product Name:Benzene, pentachloro(2-methyl-2-propenyl)-
CAS No:63249-12-7
MF:C10H7Cl5
MW:304.427578210831
CID:1649530
PubChem ID:71381337
Update Time:2025-04-21
Benzene, pentachloro(2-methyl-2-propenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, pentachloro(2-methyl-2-propenyl)-
- 1,2,3,4,5-pentachloro-6-(2-methylprop-2-enyl)benzene
- 63249-12-7
- 1,2,3,4,5-Pentachloro-6-(2-methylprop-2-en-1-yl)benzene
- DTXSID80803793
-
- Inchi： 1S/C10H7Cl5/c1-4(2)3-5-6(11)8(13)10(15)9(14)7(5)12/h1,3H2,2H3
- InChI Key： MZFRJKSLWRZRRA-UHFFFAOYSA-N
- SMILES： ClC1C(=C(C(=C(C=1CC(=C)C)Cl)Cl)Cl)Cl
Computed Properties
- Exact Mass: 301.89931
- Monoisotopic Mass: 301.899039g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 226
- 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: 6.8
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0
Benzene, pentachloro(2-methyl-2-propenyl)- Related Literature
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Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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