| CAS Number | 1147558-13-1 |
| Catalog Number | AG000F5Z(AGN-PC-0WCKCH) |
| Chemical Name | Benzenamine, 4-(cyclopropylsulfonyl)- |
| IUPAC Name | 4-cyclopropylsulfonylaniline |
| InChI | InChI=1S/C9H11NO2S/c10-7-1-3-8(4-2-7)13(11,12)9-5-6-9/h1-4,9H,5-6,10H2 |
| InChI Key | JRPZKEUELSTMFP-UHFFFAOYSA-N |
| MDL Number | MFCD11935615 |
| Molecular Formula | C9H11NO2S |
| Molecular Weight | 197.2541 |
| SMILES | NC1=CC=C(S(=O)(C2CC2)=O)C=C1 |
| Synonyms | 4-(cyclopropanesulfonyl)aniline,
1147558-13-1,
4-(CYCLOPROPYLSULFONYL)ANILINE,
4-Cyclopropanesulphonylphenylamine,
SCHEMBL2149410,
JRPZKEUELSTMFP-UHFFFAOYSA-N,
KS-000005IV,
MFCD11935615,
ZINC32009534,
Benzenamine, 4-(cyclopropylsulfonyl)-,
AS-36085,
CS-0051163,
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| Complexity | 269 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 197.051g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 197.252g/mol |
| Monoisotopic Mass | 197.051g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 68.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number