Cas no 32427-94-4 (1-Propanaminium,N,N-diethyl-3-hydroxy-N-methyl-, chloride (1:1))
32427-94-4 structure
Product Name:1-Propanaminium,N,N-diethyl-3-hydroxy-N-methyl-, chloride (1:1)
CAS No:32427-94-4
MF:C8H20ClNO
MW:181.703501701355
CID:309126
PubChem ID:3082343
Update Time:2025-04-19
1-Propanaminium,N,N-diethyl-3-hydroxy-N-methyl-, chloride (1:1) Chemical and Physical Properties
Names and Identifiers
-
- 1-Propanaminium,N,N-diethyl-3-hydroxy-N-methyl-, chloride (1:1)
- diethyl-(3-hydroxypropyl)-methylazanium,chloride
- N,N-Diethylhomocholine
- 32427-94-4
- 1-Propanaminium, N,N-diethyl-3-hydroxy-N-methyl-, chloride
- N,N-Diethyl-3-hydroxy-N-methylpropan-1-aminium chloride
- diethyl-(3-hydroxypropyl)-methylazanium;chloride
- DTXSID30954188
-
- Inchi： 1S/C8H20NO.ClH/c1-4-9(3,5-2)7-6-8-10;/h10H,4-8H2,1-3H3;1H/q+1;/p-1
- InChI Key： IAYDRPZUPDPOTO-UHFFFAOYSA-M
- SMILES： [Cl-].OCCC[N+](C)(CC)CC
Computed Properties
- Exact Mass: 160.9669
- Monoisotopic Mass: 181.123
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 5
- Complexity: 79.3
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 20.2?2
Experimental Properties
- Boiling Point: °Cat760mmHg
- Flash Point: °C
- PSA: 19.9
1-Propanaminium,N,N-diethyl-3-hydroxy-N-methyl-, chloride (1:1) Related Literature
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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