Cas no 74051-20-0 (Benzeneethanamine, a-ethyl-3-(trifluoromethyl)-)
74051-20-0 structure
Product Name:Benzeneethanamine, a-ethyl-3-(trifluoromethyl)-
CAS No:74051-20-0
MF:C11H14F3N
MW:217.230773448944
CID:564235
PubChem ID:130837
Update Time:2023-10-31
Benzeneethanamine, a-ethyl-3-(trifluoromethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzeneethanamine, a-ethyl-3-(trifluoromethyl)-
- 1-[3-(Trifluoromethyl)phenyl]-2-butanamine
- alpha-ethylnorfenfluramine
- N14541
- 74051-20-0
- LS-103516
- alpha-Ethyl-m-trifluoromethylphenethylamine
- 1-(3-TRIFLUOROMETHYL-PHENYL)-2-BUTANAMINE
- Phenethylamine, alpha-ethyl-m-trifluoromethyl-
- PGSHQQWAARQLIC-UHFFFAOYSA-N
- alpha-Ethyl-3-(trifluoromethyl)benzeneethanamine
- DTXSID60995483
- 1-[3-(trifluoromethyl)phenyl]butan-2-amine
- Benzeneethanamine, .alpha.-ethyl-3-(trifluoromethyl)-
-
- Inchi： 1S/C11H14F3N/c1-2-10(15)7-8-4-3-5-9(6-8)11(12,13)14/h3-6,10H,2,7,15H2,1H3
- InChI Key： PGSHQQWAARQLIC-UHFFFAOYSA-N
- SMILES： FC(C1=CC=CC(=C1)CC(CC)N)(F)F
Computed Properties
- Exact Mass: 217.10783394g/mol
- Monoisotopic Mass: 217.10783394g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 191
- 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
- XLogP3: 3.2
- Topological Polar Surface Area: 26?2
Experimental Properties
- Density: 1.126
- Boiling Point: 235.1°C at 760 mmHg
- Flash Point: 99.3°C
- Refractive Index: 1.467
Benzeneethanamine, a-ethyl-3-(trifluoromethyl)- Related Literature
-
Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
-
5. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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