Cas no 22458-63-5 (1-Isocyanato-2-(3-isocyanatopropyl)cyclohexane)
22458-63-5 structure
Product Name:1-Isocyanato-2-(3-isocyanatopropyl)cyclohexane
CAS No:22458-63-5
MF:C11H16N2O2
MW:208.256942749023
CID:2658893
Update Time:2023-08-06
1-Isocyanato-2-(3-isocyanatopropyl)cyclohexane Chemical and Physical Properties
Names and Identifiers
-
- 1-isocyanato-2-(3-isocyanatopropyl)cyclohexane
- 3-(2-isocyanatocyclohexyl)propyl isocyanate
- 1-Isocyanato-2-(3-isocyanatopropyl)cyclohexane
-
- Inchi： 1S/C11H16N2O2/c14-8-12-7-3-5-10-4-1-2-6-11(10)13-9-15/h10-11H,1-7H2
- InChI Key： KANVKUMQZXAJGG-UHFFFAOYSA-N
- SMILES： O=C=NC1CCCCC1CCCN=C=O
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 5
- Complexity: 278
- Topological Polar Surface Area: 58.9
1-Isocyanato-2-(3-isocyanatopropyl)cyclohexane Related Literature
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Doug Ogrin,Laura H. van Poppel,Simon G. Bott,Andrew R. Barron Dalton Trans., 2004, 3689-3694
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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