| CAS Number | 1195901-44-0 |
| Catalog Number | AG0090C3(AGN-PC-0WBODR) |
| Chemical Name | [3-(4-Fluorophenyl)phenyl]methylamine, HCl |
| IUPAC Name | [3-(4-fluorophenyl)phenyl]methanamine;hydrochloride |
| InChI | InChI=1S/C13H12FN.ClH/c14-13-6-4-11(5-7-13)12-3-1-2-10(8-12)9-15;/h1-8H,9,15H2;1H |
| InChI Key | ZYGOVJWOSPPYEB-UHFFFAOYSA-N |
| MDL Number | MFCD02089423 |
| Molecular Formula | C13H13ClFN |
| Molecular Weight | 237.7004 |
| SMILES | NCC1=CC(C2=CC=C(F)C=C2)=CC=C1.Cl |
| Synonyms | 1195901-44-0,
[3-(4-FLUOROPHENYL)PHENYL]METHYLAMINEHCL,
[3-(4-Fluorophenyl)phenyl]methylamine, HCl,
MFCD02089423,
1-(4'-FLUOROBIPHENYL-3-YL)METHYLAMINE HYDROCHLORIDE,
4'-Fluoro-3-biphenylmethylamine hydrochloride,
SCHEMBL20493997,
CTK7E5336,
DTXSID90592106,
4486AH,
AR1649,
AS-45179,
A-8470,
1-(4-Fluorobiphenyl-3-yl)methylamine hydrochloride,
4'-FLUOROBIPHENYL-3-METHYLAMINE HYDROCHLORIDE,
1-(4'-fluorobiphenyl-3-yl)methylamine hydrochloride, AldrichCPR,
1-(4'-Fluoro[1,1'-biphenyl]-3-yl)methanamine--hydrogen chloride (1/1),
C13H12FN.HCl,
|
| Complexity | 187 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 237.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 237.702g/mol |
| Monoisotopic Mass | 237.072g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number