Cas no 90066-15-2 (1-Piperazinepropanesulfonic acid, 4-tetradecyl-)
90066-15-2 structure
Product Name:1-Piperazinepropanesulfonic acid, 4-tetradecyl-
CAS No:90066-15-2
MF:C21H44N2O3S
MW:404.650665283203
CID:794995
PubChem ID:13214644
Update Time:2025-04-19
1-Piperazinepropanesulfonic acid, 4-tetradecyl- Chemical and Physical Properties
Names and Identifiers
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- 1-Piperazinepropanesulfonic acid, 4-tetradecyl-
- 3-(4-tetradecylpiperazin-1-yl)propane-1-sulfonic acid
- DTXSID30528747
- 90066-15-2
-
- Inchi： 1S/C21H44N2O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-22-17-19-23(20-18-22)16-14-21-27(24,25)26/h2-21H2,1H3,(H,24,25,26)
- InChI Key： XRWXSGVUOWZULW-UHFFFAOYSA-N
- SMILES： S(CCCN1CCN(CCCCCCCCCCCCCC)CC1)(=O)(=O)O
Computed Properties
- Exact Mass: 404.30726444g/mol
- Monoisotopic Mass: 404.30726444g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 27
- Rotatable Bond Count: 17
- Complexity: 429
- 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: 3.7
- Topological Polar Surface Area: 69.2?2
1-Piperazinepropanesulfonic acid, 4-tetradecyl- Related Literature
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
90066-15-2 (1-Piperazinepropanesulfonic acid, 4-tetradecyl-) Related Products
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