Cas no 139653-29-5 (1-Octadecanaminium, N,N-dimethyl-N-octadecyl-, thiocyanate)
139653-29-5 structure
Product Name:1-Octadecanaminium, N,N-dimethyl-N-octadecyl-, thiocyanate
CAS No:139653-29-5
MF:C39H80N2S
MW:609.130910873413
CID:1277656
Update Time:2024-08-03
1-Octadecanaminium, N,N-dimethyl-N-octadecyl-, thiocyanate Chemical and Physical Properties
Names and Identifiers
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- 1-Octadecanaminium, N,N-dimethyl-N-octadecyl-, thiocyanate
- 1-Octadecanaminium, N,N-dimethyl-N-octadecyl-, thiocyanate (1:1)
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- Inchi： 1S/C38H80N.CHNS/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39(3,4)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2;2-1-3/h5-38H2,1-4H3;3H/q+1;/p-1
- InChI Key： QVDKECREYCJEQJ-UHFFFAOYSA-M
- SMILES： C([S-])#N.C(CCCCCCCCCCCCCCCCC)[N+](C)(C)CCCCCCCCCCCCCCCCCC
Computed Properties
- Exact Mass: 608.6047
Experimental Properties
- PSA: 23.79
1-Octadecanaminium, N,N-dimethyl-N-octadecyl-, thiocyanate Related Literature
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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