| CAS Number | 634150-90-6 |
| Catalog Number | AG00EE9W(AGN-PC-0WB56S) |
| Chemical Name | 1-(4-Ethoxy-3-fluorophenyl)ethanamine |
| IUPAC Name | 1-(4-ethoxy-3-fluorophenyl)ethanamine |
| InChI | InChI=1S/C10H14FNO/c1-3-13-10-5-4-8(7(2)12)6-9(10)11/h4-7H,3,12H2,1-2H3 |
| InChI Key | OFDISMSWWNOGFW-UHFFFAOYSA-N |
| MDL Number | MFCD05215366 |
| Molecular Formula | C10H14FNO |
| Molecular Weight | 183.2227 |
| SMILES | C1(F)=C(OCC)C=CC(C(C)N)=C1 |
| Synonyms | 1-(4-ethoxy-3-fluorophenyl)ethanamine,
634150-90-6,
AC1N6KQB,
CTK5B9074,
DTXSID60401352,
ALBB-004961,
MFCD05215366,
STK501500,
AKOS000219993,
AKOS016345397,
1-(4-ethoxy-3-fluorophenyl)ethan-1-amine,
TR-058507,
Y-1669,
1-(4-Ethoxy-3-fluorophenyl)ethanamine, AldrichCPR,
Benzenemethanamine, 4-ethoxy-3-fluoro-alpha-methyl- (9CI),
CID4261556,
1-(4-ethoxy-3-fluoro-phenyl)ethanamine,
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| Complexity | 154 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 183.106g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 183.226g/mol |
| Monoisotopic Mass | 183.106g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number