Cas no 651303-49-0 (Benzene, 1,1',1''-[(4-iodophenyl)methylidyne]tris[4-methyl-)
![Benzene, 1,1',1''-[(4-iodophenyl)methylidyne]tris[4-methyl- structure](https://ossimg.kuujia.com/scimg/651500/651303-49-0x500.png)
651303-49-0 structure
Product Name:Benzene, 1,1',1''-[(4-iodophenyl)methylidyne]tris[4-methyl-
CAS No:651303-49-0
MF:C28H25I
MW:488.402580022812
CID:406665
PubChem ID:66695586
Update Time:2025-04-19
Benzene, 1,1',1''-[(4-iodophenyl)methylidyne]tris[4-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1,1',1''-[(4-iodophenyl)methylidyne]tris[4-methyl-
- 1-iodo-4-[tris(4-methylphenyl)methyl]benzene
- SCHEMBL469946
- 1,1',1''-[(4-Iodophenyl)methanetriyl]tris(4-methylbenzene)
- DTXSID70735594
- 651303-49-0
-
- Inchi： 1S/C28H25I/c1-20-4-10-23(11-5-20)28(24-12-6-21(2)7-13-24,25-14-8-22(3)9-15-25)26-16-18-27(29)19-17-26/h4-19H,1-3H3
- InChI Key： RHMKWIZFPMJUTB-UHFFFAOYSA-N
- SMILES： IC1C=CC(=CC=1)C(C1C=CC(C)=CC=1)(C1C=CC(C)=CC=1)C1C=CC(C)=CC=1
Computed Properties
- Exact Mass: 488.09975
- Monoisotopic Mass: 488.10010g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 0
- Heavy Atom Count: 29
- Rotatable Bond Count: 4
- Complexity: 425
- 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: 8.7
- Topological Polar Surface Area: 0?2
Experimental Properties
- PSA: 0
Benzene, 1,1',1''-[(4-iodophenyl)methylidyne]tris[4-methyl- Related Literature
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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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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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
651303-49-0 (Benzene, 1,1',1''-[(4-iodophenyl)methylidyne]tris[4-methyl-) Related Products
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