Cas no 677751-53-0 (2,4,5-Trichloro-6-iodobenzene-1,3-dicarbonitrile)
677751-53-0 structure
Product Name:2,4,5-Trichloro-6-iodobenzene-1,3-dicarbonitrile
CAS No:677751-53-0
MF:C8Cl3IN2
MW:357.362470626831
CID:2798395
PubChem ID:71367695
Update Time:2025-04-21
2,4,5-Trichloro-6-iodobenzene-1,3-dicarbonitrile Chemical and Physical Properties
Names and Identifiers
-
- 677751-53-0
- 2,5,6-trichloro-4-iodoisophthalonitrile
- 2,4,5-Trichloro-6-iodobenzene-1,3-dicarbonitrile
- DTXSID90790807
-
- Inchi： 1S/C8Cl3IN2/c9-5-3(1-13)6(10)7(11)8(12)4(5)2-14
- InChI Key： OVYQAZOBAQNBQH-UHFFFAOYSA-N
- SMILES： IC1=C(C(=C(C#N)C(=C1C#N)Cl)Cl)Cl
Computed Properties
- Exact Mass: 355.81718Da
- Monoisotopic Mass: 355.81718Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 0
- Complexity: 317
- 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: 3.9
- Topological Polar Surface Area: 47.6?2
2,4,5-Trichloro-6-iodobenzene-1,3-dicarbonitrile Related Literature
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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