Cas no 62552-48-1 (Thiourea, N-dodecyl-N'-hexyl-)
Thiourea, N-dodecyl-N'-hexyl- structure
Product Name:Thiourea, N-dodecyl-N'-hexyl-
CAS No:62552-48-1
MF:C19H40N2S
MW:328.599304199219
CID:440549
PubChem ID:20322755
Update Time:2025-04-19
Thiourea, N-dodecyl-N'-hexyl- Chemical and Physical Properties
Names and Identifiers
-
- Thiourea, N-dodecyl-N'-hexyl-
- 1-dodecyl-3-hexylthiourea
- SCHEMBL11594314
- N-Dodecyl-N'-hexylthiourea
- DTXSID50605281
- 62552-48-1
-
- Inchi： 1S/C19H40N2S/c1-3-5-7-9-10-11-12-13-14-16-18-21-19(22)20-17-15-8-6-4-2/h3-18H2,1-2H3,(H2,20,21,22)
- InChI Key： IKRUSPOTQBTILL-UHFFFAOYSA-N
- SMILES： S=C(NCCCCCC)NCCCCCCCCCCCC
Computed Properties
- Exact Mass: 328.2915
- Monoisotopic Mass: 328.29122046g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 22
- Rotatable Bond Count: 16
- Complexity: 232
- 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: 7.9
- Topological Polar Surface Area: 56.2?2
Experimental Properties
- PSA: 24.06
Thiourea, N-dodecyl-N'-hexyl- Related Literature
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Jason Wan Lab Chip, 2020,20, 4528-4538
62552-48-1 (Thiourea, N-dodecyl-N'-hexyl-) Related Products
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