Cas no 921595-58-6 (Benzene, 1,2,4-tris-(chloromethyl))
921595-58-6 structure
Product Name:Benzene, 1,2,4-tris-(chloromethyl)
Benzene, 1,2,4-tris-(chloromethyl) Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1,2,4-trichloromethyl-
- 1,2,4-tris(chloromethyl)benzene
- Benzene, 1,2,4-tris-(chloromethyl)
- WWOFGTSYQPBRHF-UHFFFAOYSA-N
-
- Inchi： 1S/C9H9Cl3/c10-4-7-1-2-8(5-11)9(3-7)6-12/h1-3H,4-6H2
- InChI Key： WWOFGTSYQPBRHF-UHFFFAOYSA-N
- SMILES： ClCC1C=C(CCl)C=CC=1CCl
Computed Properties
- Exact Mass: 221.976983g/mol
- Monoisotopic Mass: 221.976983g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 127
- 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
- Topological Polar Surface Area: 0
- XLogP3: 3.1
Benzene, 1,2,4-tris-(chloromethyl) Related Literature
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M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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