479407-07-3
ETHANAMINIUM, N-(2-FLUOROETHYL)-2-HYDROXY-N,N-DIMETHYL-, SALT WITH 4-METHYLBENZENESULFONIC ACID
NameETHANAMINIUM, N-(2-FLUOROETHYL)-2-HYDROXY-N,N-DIMETHYL-, SALT WITH 4-METHYLBENZENESULFONIC ACID
pro_formulaC7 H7 O3 S . C6 H15 F N O
1Identification
【Name】
ETHANAMINIUM, N-(2-FLUOROETHYL)-2-HYDROXY-N,N-DIMETHYL-, SALT WITH 4-METHYLBENZENESULFONIC ACID
【CAS】
【MDL】
MFCD08061478
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C7 H7 O3 S . C6 H15 F N O
【pro_molWeight】
307.384
【Inchi】
InChI=1S/C7H8O3S.C6H15FNO/c1-6-2-4-7(5-3-6)11(8,9)10;1-8(2,4-3-7)5-6-9/h2-5H,1H3,(H,8,9,10);9H,3-6H2,1-2H3/q;+1/p-1
【InChIKey】
InChIKey=NRGASHBZQVBHTN-UHFFFAOYSA-M
【SMILES】
Cc1ccc(cc1)S(=O)(=O)[O-].C[N+](C)(CCO)CCF
【MOL File】
ETHANAMINIUM, N-(2-F….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:3
XLogP3:0.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
ETHANAMINIUM, N-(2-FLUOROETHYL)-2-HYDROXY-N,N-DIMETHYL-, SALT WITH 4-METHYLBENZENESULFONIC ACID.cml