| CAS Number | 143380-24-9 |
| Catalog Number | AG01AJQV(AGN-PC-0PTXGF) |
| Chemical Name | 1-(3-Methylthiophen-2-yl)-2-phenylethan-1-amine |
| IUPAC Name | 1-(3-methylthiophen-2-yl)-2-phenylethanamine |
| InChI | InChI=1S/C13H15NS/c1-10-7-8-15-13(10)12(14)9-11-5-3-2-4-6-11/h2-8,12H,9,14H2,1H3 |
| InChI Key | VCWBYJUTEWCXHW-UHFFFAOYSA-N |
| MDL Number | MFCD00908940 |
| Molecular Formula | C13H15NS |
| Molecular Weight | 217.3299 |
| SMILES | CC1=C(C(CC2=CC=CC=C2)N)SC=C1 |
| Synonyms | 1-(3-methylthiophen-2-yl)-2-phenylethan-1-amine,
143380-24-9,
SCHEMBL8760194,
VCWBYJUTEWCXHW-UHFFFAOYSA-N,
AKOS010311797,
NE34501,
alpha-(3-methyl-2-thienyl)benzeneethanamine,
EN300-81741,
|
| Complexity | 189 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 217.093g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 217.33g/mol |
| Monoisotopic Mass | 217.093g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 54.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number