| CAS Number | 4837-29-0 |
| Catalog Number | AG019MEB(AGN-PC-0K4MM1) |
| Chemical Name | (4-((Trifluoromethyl)sulfonyl)phenyl)hydrazine |
| IUPAC Name | [4-(trifluoromethylsulfonyl)phenyl]hydrazine |
| InChI | InChI=1S/C7H7F3N2O2S/c8-7(9,10)15(13,14)6-3-1-5(12-11)2-4-6/h1-4,12H,11H2 |
| InChI Key | SIJLORWDYWCBPZ-UHFFFAOYSA-N |
| MDL Number | MFCD02333330 |
| Molecular Formula | C7H7F3N2O2S |
| Molecular Weight | 240.2029 |
| SMILES | NNC1=CC=C(S(C(F)(F)F)(=O)=O)C=C1 |
| Synonyms | 4837-29-0,
{4-[(trifluoromethyl)sulfonyl]phenyl}hydrazine,
(4-trifluoromethanesulfonylphenyl)hydrazine,
EN300-35898,
(4-((Trifluoromethyl)sulfonyl)phenyl)hydrazine,
4-(Trifluoromethylsulfonyl)phenylhydrazine,
AC1LRAV5,
AC1Q552C,
SCHEMBL9703315,
CTK7F1572,
ZINC1255193,
MFCD02333330,
AKOS003630599,
p-trifluoromethylsulfonylphenylhydrazine,
NE23236,
[4-(trifluoromethylsulfonyl)phenyl]hydrazine,
ZINC01255193,
CID1391565,
|
| Complexity | 301 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 240.018g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 7 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 240.2g/mol |
| Monoisotopic Mass | 240.018g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 80.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number