4-(Methylcarbamoyl)benzenesulfonyl Chloride - CAS 874622-79-4
Catalog: |
BB038462 |
Product Name: |
4-(Methylcarbamoyl)benzenesulfonyl Chloride |
CAS: |
874622-79-4 |
Synonyms: |
4-(methylcarbamoyl)benzenesulfonyl chloride; 4-(methylcarbamoyl)benzenesulfonyl chloride |
IUPAC Name: | 4-(methylcarbamoyl)benzenesulfonyl chloride |
Description: | 4-(Methylcarbamoyl)benzenesulfonyl Chloride (CAS# 874622-79-4) is a useful research chemical. |
Molecular Weight: | 233.67 |
Molecular Formula: | C8H8ClNO3S |
Canonical SMILES: | CNC(=O)C1=CC=C(C=C1)S(=O)(=O)Cl |
InChI: | InChI=1S/C8H8ClNO3S/c1-10-8(11)6-2-4-7(5-3-6)14(9,12)13/h2-5H,1H3,(H,10,11) |
InChI Key: | BNMWGTKOMIXMRX-UHFFFAOYSA-N |
LogP: | 2.44540 |
GHS Hazard Statement: | H317 (97.44%): May cause an allergic skin reaction [Warning Sensitization, Skin] |
Precautionary Statement: | P261, P264, P272, P280, P302+P352, P305+P351+P338, P321, P333+P313, P337+P313, P363, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-111943889-A | Bis-aryl amine compound and preparation method and application thereof | 20200724 |
WO-2020102574-A1 | The compounds and compositions for treating conditions associated with nlrp activity | 20181116 |
WO-2020102576-A1 | Compounds and compositions for treating conditions associated with nlrp activity | 20181116 |
WO-2019023145-A1 | COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PATHOLOGICAL CONDITIONS ASSOCIATED WITH NLRP ACTIVITY | 20170724 |
EP-3241823-A1 | Pyrrole amide compound, preparation method therefor, and use thereof | 20141229 |
Complexity: | 301 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 232.9913420 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 232.9913420 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 71.6 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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