Cas no 1120-05-4 (1-Propanesulfonic acid,3-(hexadecylamino)-)
1120-05-4 structure
Product Name:1-Propanesulfonic acid,3-(hexadecylamino)-
CAS No:1120-05-4
MF:C19H41NO3S
MW:363.598745107651
CID:209619
PubChem ID:328277
Update Time:2025-04-19
1-Propanesulfonic acid,3-(hexadecylamino)- Chemical and Physical Properties
Names and Identifiers
-
- 1-Propanesulfonic acid,3-(hexadecylamino)-
- 3-(Hexadecylamino)-1-propanesulfonic acid
- 3-(hexadecylamino)propane-1-sulfonic acid
- 3-hexadecylamino-1-propanesulfonic acid
- 4-Azonia-eicosan-1-sulfonat
- AC1L729Z
- AG-D-30816
- CTK4A7609
- N-(Bis-3-Sulfopropyl)-hexadecylamin
- N-Hexadecyl-3-aminopropan-sulfonsaeure
- NSC306431
- NSC 306431
- 1120-05-4
- RWN9KQ5EYA
- NSC-306431
- SCHEMBL917965
- N-hexadecyl-3-aminopropanesulfonic acid
- 1-Propanesulfonic acid, 3-(hexadecylamino)-
- DTXSID00149802
-
- Inchi： 1S/C19H41NO3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-20-18-16-19-24(21,22)23/h20H,2-19H2,1H3,(H,21,22,23)
- InChI Key： FBONKMDYOCCKKV-UHFFFAOYSA-N
- SMILES： S(CCCNCCCCCCCCCCCCCCCC)(=O)(=O)O
Computed Properties
- Exact Mass: 363.28093
- Monoisotopic Mass: 363.281
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 24
- Rotatable Bond Count: 19
- Complexity: 339
- 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
- Topological Polar Surface Area: 74.8?2
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 4.5
Experimental Properties
- Density: 0.983
- Boiling Point: °Cat760mmHg
- Flash Point: °C
- Refractive Index: 1.474
- PSA: 66.4
1-Propanesulfonic acid,3-(hexadecylamino)- Related Literature
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Jonas Kind,Lukas Kaltschnee,Martin Leyendecker,Christina M. Thiele Chem. Commun., 2016,52, 12506-12509
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
Related Categories
- Solvents and Organic Chemicals Organic Compounds Organic acids and derivatives Organic sulfonic acids and derivatives Organosulfonic acids
- Solvents and Organic Chemicals Organic Compounds Organic acids and derivatives Organic sulfonic acids and derivatives Organosulfonic acids and derivatives Organosulfonic acids
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