Cas no 88090-23-7 (1-Propanol, 3-(decylmethylamino)-)
88090-23-7 structure
Product Name:1-Propanol, 3-(decylmethylamino)-
CAS No:88090-23-7
MF:C14H31NO
MW:229.402044534683
CID:645682
PubChem ID:13122234
Update Time:2025-04-19
1-Propanol, 3-(decylmethylamino)- Chemical and Physical Properties
Names and Identifiers
-
- 1-Propanol, 3-(decylmethylamino)-
- 3-[decyl(methyl)amino]propan-1-ol
- DTXSID30519539
- 88090-23-7
-
- Inchi： 1S/C14H31NO/c1-3-4-5-6-7-8-9-10-12-15(2)13-11-14-16/h16H,3-14H2,1-2H3
- InChI Key： PTTJDNJJVLKGNB-UHFFFAOYSA-N
- SMILES： OCCCN(C)CCCCCCCCCC
Computed Properties
- Exact Mass: 229.240564612g/mol
- Monoisotopic Mass: 229.240564612g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 12
- Complexity: 128
- 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: 4.4
- Topological Polar Surface Area: 23.5?2
1-Propanol, 3-(decylmethylamino)- Related Literature
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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