| CAS Number | 1019534-84-9 |
| Catalog Number | AG019LTC(AGN-PC-0WOW7M) |
| Chemical Name | benzyl[1-(thiophen-2-yl)ethyl]amine |
| IUPAC Name | N-benzyl-1-thiophen-2-ylethanamine |
| InChI | InChI=1S/C13H15NS/c1-11(13-8-5-9-15-13)14-10-12-6-3-2-4-7-12/h2-9,11,14H,10H2,1H3 |
| InChI Key | QUUMHQDUGIQJST-UHFFFAOYSA-N |
| MDL Number | MFCD03985208 |
| Molecular Formula | C13H15NS |
| Molecular Weight | 217.3299 |
| SMILES | CC(C1SC=CC=1)NCC1=CC=CC=C1 |
| Synonyms | benzyl[1-(thiophen-2-yl)ethyl]amine,
1019534-84-9,
AC1Q2BNA,
AKOS000226317,
AKOS017273318,
MCULE-8379782918,
NE33817,
EN300-32626,
Z86168337,
|
| Complexity | 177 |
| 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 | 4 |
| Topological Polar Surface Area | 40.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number