| CAS Number | 86093-77-8 |
| Catalog Number | AG008FJ0(AGN-PC-0KKTER) |
| Chemical Name | Thiophene,3-(trifluoromethyl)- |
| IUPAC Name | 3-(trifluoromethyl)thiophene |
| InChI | InChI=1S/C5H3F3S/c6-5(7,8)4-1-2-9-3-4/h1-3H |
| InChI Key | CORHGUPIEQAJDV-UHFFFAOYSA-N |
| MDL Number | MFCD07368926 |
| Molecular Formula | C5H3F3S |
| Molecular Weight | 152.1375 |
| SMILES | C(F)(F)(F)c1ccsc1 |
| Synonyms | 3-(trifluoromethyl)thiophene,
86093-77-8,
Thiophene,3-(trifluoromethyl)-,
AC1MCH0V,
3-trifluoromethylthiophene,
SCHEMBL827480,
CTK5F6251,
DTXSID50377739,
Thiophene, 3-(trifluoromethyl)-,
CORHGUPIEQAJDV-UHFFFAOYSA-N,
ZINC15440554,
AKOS006285322,
FS-6489,
A841556,
3- THIOPHENE,
ACN-054276,
CID2769441,
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| Complexity | 98.9 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 151.991g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 152.134g/mol |
| Monoisotopic Mass | 151.991g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 28.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number