| CAS Number | 852934-06-6 |
| Catalog Number | AG00G9MT(AGN-PC-0WA27D) |
| Chemical Name | (4-Ethylphenyl)(3-fluorophenyl)methylamine |
| IUPAC Name | 4-ethyl-N-[(3-fluorophenyl)methyl]aniline |
| InChI | InChI=1S/C15H16FN/c1-2-12-6-8-15(9-7-12)17-11-13-4-3-5-14(16)10-13/h3-10,17H,2,11H2,1H3 |
| InChI Key | BWSJQBHJGAMYGK-UHFFFAOYSA-N |
| MDL Number | MFCD06655634 |
| Molecular Formula | C15H16FN |
| Molecular Weight | 229.2926 |
| SMILES | CCC1=CC=C(C(C2=CC(F)=CC=C2)N)C=C1 |
| Synonyms | 4-Ethyl-N-(3-fluorobenzyl)aniline,
852934-06-6,
1019492-41-1,
ACMC-209q5i,
CTK6D1614,
DTXSID80651473,
ZX-AH017198,
ANW-38164,
MFCD11146035,
ZINC19955094,
AKOS000238177,
N-(4-Ethylphenyl)-3-fluorobenzylamine,
ABA-9373376,
AJ-75815,
4-ethyl-N-[(3-fluorophenyl)methyl]aniline,
AX8230617,
TC-126909,
ST24023532,
V8089,
(4-ethylphenyl)(3-fluorophenyl)methylamine,
C15H16FN,
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| Complexity | 211 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 229.127g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 229.298g/mol |
| Monoisotopic Mass | 229.127g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number