Cas no 53457-87-7 (1-Propanol, 3-(dipentylamino)-)
53457-87-7 structure
Product Name:1-Propanol, 3-(dipentylamino)-
CAS No:53457-87-7
MF:C13H29NO
MW:215.375464200974
CID:357206
PubChem ID:21553615
Update Time:2025-04-19
1-Propanol, 3-(dipentylamino)- Chemical and Physical Properties
Names and Identifiers
-
- 1-Propanol, 3-(dipentylamino)-
- 3-(dipentylamino)propan-1-ol
- 53457-87-7
- SCHEMBL4931089
- DTXSID10615821
-
- Inchi： 1S/C13H29NO/c1-3-5-7-10-14(12-9-13-15)11-8-6-4-2/h15H,3-13H2,1-2H3
- InChI Key： PEOJPNIUFUJIKD-UHFFFAOYSA-N
- SMILES： OCCCN(CCCCC)CCCCC
Computed Properties
- Exact Mass: 215.22507
- Monoisotopic Mass: 215.224914549g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 11
- Complexity: 107
- 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: 3.5
- Topological Polar Surface Area: 23.5?2
Experimental Properties
- PSA: 23.47
1-Propanol, 3-(dipentylamino)- Related Literature
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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