Cas no 7562-87-0 (1-Propanaminium,2-hydroxy-N,N,N-trimethyl-)
7562-87-0 structure
Product Name:1-Propanaminium,2-hydroxy-N,N,N-trimethyl-
1-Propanaminium,2-hydroxy-N,N,N-trimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 1-Propanaminium,2-hydroxy-N,N,N-trimethyl-
- (2-hydroxypropyl)trimethylammonium
- 2-hydroxypropyl(trimethyl)azanium
- 2-Methylcholine
- 842Q90137O
- Q27102192
- CHEBI:17059
- AMMONIUM, (2-HYDROXYPROPYL)TRIMETHYL-
- CHOLINE, .BETA.-METHYL-
- BETA-METHYLCHOLINE [USP IMPURITY]
- 1-Propanaminium, 2-hydroxy-N,N,N-trimethyl-
- DL-.BETA.-METHYLCHOLINE
- .BETA.-METHYLCHOLINE
- CHEMBL107582
- DESACETYL METHA CHOLINE [USP IMPURITY]
- BDBM50147112
- DTXSID90864092
- beta-Methylcholine
- EINECS 231-457-6
- 7562-87-0
- UNII-842Q90137O
- SCHEMBL193840
- NS00046433
- 2-hydroxy-N,N,N-trimethylpropanaminium
- 2-Hydroxy-N,N,N-trimethylpropan-1-aminium
- C02224
-
- Inchi： 1S/C6H16NO/c1-6(8)5-7(2,3)4/h6,8H,5H2,1-4H3/q+1
- InChI Key： JPKKMFOXWKNEEN-UHFFFAOYSA-N
- SMILES： OC(C)C[N+](C)(C)C
Computed Properties
- Exact Mass: 118.12300
- Monoisotopic Mass: 118.123
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 8
- Rotatable Bond Count: 2
- Complexity: 65.4
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 20.2A^2
- XLogP3: 0
Experimental Properties
- PSA: 20.23000
- LogP: 0.07340
1-Propanaminium,2-hydroxy-N,N,N-trimethyl- Related Literature
-
Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
-
Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
-
Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
-
Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
-
Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
7562-87-0 (1-Propanaminium,2-hydroxy-N,N,N-trimethyl-) Related Products
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