Cas no 55792-38-6 (Benzene, 1-isocyanato-2-(nonyloxy)-)
55792-38-6 structure
Product Name:Benzene, 1-isocyanato-2-(nonyloxy)-
CAS No:55792-38-6
MF:C16H23NO2
MW:261.35932469368
CID:350887
PubChem ID:13904857
Update Time:2025-04-19
Benzene, 1-isocyanato-2-(nonyloxy)- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1-isocyanato-2-(nonyloxy)-
- 1-isocyanato-2-nonoxybenzene
- 55792-38-6
- 1-ISOCYANATO-2-(NONYLOXY)BENZENE
- DTXSID00552216
-
- Inchi： 1S/C16H23NO2/c1-2-3-4-5-6-7-10-13-19-16-12-9-8-11-15(16)17-14-18/h8-9,11-12H,2-7,10,13H2,1H3
- InChI Key： WAQZKHFOTWBBBR-UHFFFAOYSA-N
- SMILES： O(C1C=CC=CC=1N=C=O)CCCCCCCCC
Computed Properties
- Exact Mass: 261.17299
- Monoisotopic Mass: 261.172878976g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 19
- Rotatable Bond Count: 10
- Complexity: 262
- 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: 6.7
- Topological Polar Surface Area: 38.7?2
Experimental Properties
- PSA: 38.66
Benzene, 1-isocyanato-2-(nonyloxy)- Related Literature
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
55792-38-6 (Benzene, 1-isocyanato-2-(nonyloxy)-) Related Products
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- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
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- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
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