| CAS Number | 328028-27-9 |
| Catalog Number | AG019H0R(AGN-PC-0WC4RJ) |
| Chemical Name | 2-Chloro-5-(pyrrolidin-1-ylsulfonyl)aniline |
| IUPAC Name | 2-chloro-5-pyrrolidin-1-ylsulfonylaniline |
| InChI | InChI=1S/C10H13ClN2O2S/c11-9-4-3-8(7-10(9)12)16(14,15)13-5-1-2-6-13/h3-4,7H,1-2,5-6,12H2 |
| InChI Key | GOKCSPWMCMIFNZ-UHFFFAOYSA-N |
| MDL Number | MFCD02704623 |
| Molecular Formula | C10H13ClN2O2S |
| Molecular Weight | 260.7404 |
| SMILES | ClC1=C(N)C=C(C=C1)S(=O)(=O)N1CCCC1 |
| Synonyms | 2-chloro-5-(pyrrolidine-1-sulfonyl)aniline,
328028-27-9,
2-CHLORO-5-(1-PYRROLIDINYLSULFONYL)ANILINE,
2-chloro-5-(pyrrolidin-1-ylsulfonyl)aniline,
2-Chloro-5-(pyrrolidine-1-sulfonyl)-phenylamine,
BAS 09105947,
AC1MGMXX,
AC1Q50ZP,
CTK6H1236,
ZINC3885351,
STL283934,
AKOS000115649,
MCULE-6328580089,
NE12185,
AJ-47188,
2-chloro-5-pyrrolidin-1-ylsulfonylaniline,
TR-069437,
EN300-02129,
Z56785496,
ZINC03885351,
CID2963514,
|
| Complexity | 335 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 260.039g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 260.736g/mol |
| Monoisotopic Mass | 260.039g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 71.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number