| CAS Number | 24906-75-0 |
| Catalog Number | AG002PTM(AGN-PC-0JV9YN) |
| Chemical Name | 2-((difluoromethyl)sulfonyl)aniline |
| IUPAC Name | 2-(difluoromethylsulfonyl)aniline;hydrochloride |
| InChI | InChI=1S/C7H7F2NO2S.ClH/c8-7(9)13(11,12)6-4-2-1-3-5(6)10;/h1-4,7H,10H2;1H |
| InChI Key | LSBGBCYXFNZFJU-UHFFFAOYSA-N |
| MDL Number | MFCD08447151 |
| Molecular Formula | C7H7F2NO2S |
| Molecular Weight | 207.1978 |
| SMILES | NC1=C(S(C(F)F)(=O)=O)C=CC=C1 |
| Synonyms | 2-[(difluoromethyl)sulfonyl]aniline hydrochloride,
24906-75-0,
2-difluoromethanesulfonylaniline hydrochloride,
2-((Difluoromethyl)sulfonyl)aniline hydrochloride,
1172364-87-2,
AC1Q3CZF,
CTK8F3921,
DTXSID40610041,
MFCD08447151,
NE59984,
EN300-12164,
2-(difluoromethylsulfonyl)aniline hydrochloride,
2-(Difluoromethanesulfonyl)aniline--hydrogen chloride (1/1),
|
| Complexity | 260 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 242.993g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 243.653g/mol |
| Monoisotopic Mass | 242.993g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 68.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number