Cas no 62569-36-2 (Thiourea, N-sec-hexyl-N'-octyl-)
62569-36-2 structure
Product Name:Thiourea, N-sec-hexyl-N'-octyl-
CAS No:62569-36-2
MF:C15H32N2S
MW:272.49298286438
CID:439879
PubChem ID:20322744
Update Time:2025-04-19
Thiourea, N-sec-hexyl-N'-octyl- Chemical and Physical Properties
Names and Identifiers
-
- Thiourea, N-sec-hexyl-N'-octyl-
- 1-hexan-2-yl-3-octylthiourea
- SCHEMBL11596669
- 62569-36-2
- N-Hexan-2-yl-N'-octylthiourea
- DTXSID40605270
-
- Inchi： 1S/C15H32N2S/c1-4-6-8-9-10-11-13-16-15(18)17-14(3)12-7-5-2/h14H,4-13H2,1-3H3,(H2,16,17,18)
- InChI Key： LBRJBXYANVEYBB-UHFFFAOYSA-N
- SMILES： S=C(NCCCCCCCC)NC(C)CCCC
Computed Properties
- Exact Mass: 272.22886
- Monoisotopic Mass: 272.22862020g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 18
- Rotatable Bond Count: 11
- Complexity: 195
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 5.6
- Topological Polar Surface Area: 56.2?2
Experimental Properties
- PSA: 24.06
Thiourea, N-sec-hexyl-N'-octyl- Related Literature
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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4. 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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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
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