| CAS Number | 1193388-02-1 |
| Catalog Number | AG00VVP5(AGN-PC-0WBKXE) |
| Chemical Name | 4-fluoro-N-[(thiophen-2-yl)methyl]aniline hydrochloride |
| IUPAC Name | 4-fluoro-N-(thiophen-2-ylmethyl)aniline;hydrochloride |
| InChI | InChI=1S/C11H10FNS.ClH/c12-9-3-5-10(6-4-9)13-8-11-2-1-7-14-11;/h1-7,13H,8H2;1H |
| InChI Key | ZQEDZDNJYVMSLF-UHFFFAOYSA-N |
| MDL Number | MFCD12197374 |
| Molecular Formula | C11H11ClFNS |
| Molecular Weight | 243.7281 |
| SMILES | Cl.FC1=CC=C(NCC2SC=CC=2)C=C1 |
| Synonyms | 4-fluoro-N-(thiophen-2-ylmethyl)aniline hydrochloride,
1193388-02-1,
AC1Q3CAY,
CTK7C0925,
AKOS008030833,
MCULE-4857490755,
NE18241,
EN300-49697,
4-fluoro-N-[(thiophen-2-yl)methyl]aniline hydrochloride,
Z600397656,
|
| Complexity | 169 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 243.028g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 243.724g/mol |
| Monoisotopic Mass | 243.028g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 40.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number