| CAS Number | 1135282-94-8 |
| Catalog Number | AG0090Z6(AGN-PC-0WAXUI) |
| Chemical Name | 6-(Trifluoromethyl)-1-benzothiophene-2-carbohydrazide |
| IUPAC Name | 6-(trifluoromethyl)-1-benzothiophene-2-carbohydrazide |
| InChI | InChI=1S/C10H7F3N2OS/c11-10(12,13)6-2-1-5-3-8(9(16)15-14)17-7(5)4-6/h1-4H,14H2,(H,15,16) |
| InChI Key | UACNNQTXWMOXIK-UHFFFAOYSA-N |
| MDL Number | MFCD11615820 |
| Molecular Formula | C10H7F3N2OS |
| Molecular Weight | 260.2356 |
| SMILES | S2(C1(=C(C=CC(=C1)C(F)(F)F)C=C2C(=O)NN)) |
| Synonyms | 6-(trifluoromethyl)-1-benzothiophene-2-carbohydrazide,
1135282-94-8,
6-(trifluoromethyl)benzo[b]thiophene-2-carbohydrazide,
CTK7F0195,
KS-000021ZW,
ZX-RL001044,
SBB102296,
ZINC32911329,
AKOS005071728,
AD-0737,
MCULE-7235020683,
PC300701,
TR-064231,
RP14712,
trifluoromethylbenzothiophenecarbohydrazide,
AJ-85520,
|
| Complexity | 310 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 260.023119g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 260.24g/mol |
| Monoisotopic Mass | 260.023119g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 83.4Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number