Cas no 173206-51-4 (1,1'-Biphenyl, 4,4'-diisocyano-3,3',5,5'-tetramethyl-)
173206-51-4 structure
Product Name:1,1'-Biphenyl, 4,4'-diisocyano-3,3',5,5'-tetramethyl-
CAS No:173206-51-4
MF:C18H16N2
MW:260.333044052124
CID:1361985
PubChem ID:71353535
Update Time:2025-04-20
1,1'-Biphenyl, 4,4'-diisocyano-3,3',5,5'-tetramethyl- Chemical and Physical Properties
Names and Identifiers
-
- 1,1'-Biphenyl, 4,4'-diisocyano-3,3',5,5'-tetramethyl-
- 2-isocyano-5-(4-isocyano-3,5-dimethylphenyl)-1,3-dimethylbenzene
- 173206-51-4
- 4,4'-Diisocyano-3,3',5,5'-tetramethyl-1,1'-biphenyl
- DTXSID50778267
-
- Inchi： 1S/C18H16N2/c1-11-7-15(8-12(2)17(11)19-5)16-9-13(3)18(20-6)14(4)10-16/h7-10H,1-4H3
- InChI Key： CCERNTLXMJNPCS-UHFFFAOYSA-N
- SMILES： [N+](#[C-])C1C(C)=CC(=CC=1C)C1C=C(C)C(=C(C)C=1)[N+]#[C-]
Computed Properties
- Exact Mass: 260.13148
- Monoisotopic Mass: 260.131348519g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 20
- Rotatable Bond Count: 1
- Complexity: 371
- 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: 4.4
- Topological Polar Surface Area: 8.7?2
Experimental Properties
- PSA: 8.72
1,1'-Biphenyl, 4,4'-diisocyano-3,3',5,5'-tetramethyl- Related Literature
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
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5. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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