| CAS Number | 1146290-36-9 |
| Catalog Number | AG000EVO(AGN-PC-0WAIVV) |
| Chemical Name | Benzenesulfonyl chloride, 2-fluoro-4-nitro- |
| IUPAC Name | 2-fluoro-4-nitrobenzenesulfonyl chloride |
| InChI | InChI=1S/C6H3ClFNO4S/c7-14(12,13)6-2-1-4(9(10)11)3-5(6)8/h1-3H |
| InChI Key | FNCNMVPZFVXQTL-UHFFFAOYSA-N |
| MDL Number | MFCD11858095 |
| Molecular Formula | C6H3ClFNO4S |
| Molecular Weight | 239.6087 |
| SMILES | O=S(C1=CC=C([N+]([O-])=O)C=C1F)(Cl)=O |
| Synonyms | 2-fluoro-4-nitrobenzene-1-sulfonyl chloride,
1146290-36-9,
AC1Q1XCT,
SCHEMBL1818153,
CTK7B8110,
FNCNMVPZFVXQTL-UHFFFAOYSA-N,
KS-00000T3D,
MFCD11858095,
AKOS009807973,
ZINC100580424,
DS-8599,
NE22439,
AK174131,
Benzenesulfonyl chloride, 2-fluoro-4-nitro-,
2-Fluoro-4-nitrobenzenesulfonic acid chloride,
EN300-43514,
1-(5-Bromomethyl-2-nitro-phenyl)-ethanone,
|
| Complexity | 322 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 238.946g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 239.601g/mol |
| Monoisotopic Mass | 238.946g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 88.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
| Symbol: |   |
|
Hazard Class
|
8
|
|
Hazard statements
|
H302-H314
|
|
Packing Group
|
Ⅲ
|
|
Precautionary statements
|
P261-P280-P305+P351+P338-P310
|
|
UN Code
|
UN 3261
|
Certificate of Analysis
Lot Number