2-Butoxybenzenesulfonyl Chloride - CAS 69129-39-1
Catalog: |
BB033702 |
Product Name: |
2-Butoxybenzenesulfonyl Chloride |
CAS: |
69129-39-1 |
Synonyms: |
2-butoxybenzenesulfonyl chloride; 2-butoxybenzenesulfonyl chloride |
IUPAC Name: | 2-butoxybenzenesulfonyl chloride |
Description: | 2-Butoxybenzenesulfonyl Chloride (CAS# 69129-39-1 ) is a useful research chemical. |
Molecular Weight: | 248.73 |
Molecular Formula: | C10H13ClO3S |
Canonical SMILES: | CCCCOC1=CC=CC=C1S(=O)(=O)Cl |
InChI: | InChI=1S/C10H13ClO3S/c1-2-3-8-14-9-6-4-5-7-10(9)15(11,12)13/h4-7H,2-3,8H2,1H3 |
InChI Key: | ZRYVOOWECOSERK-UHFFFAOYSA-N |
LogP: | 3.87380 |
Publication Number | Title | Priority Date |
EP-2456435-A1 | Heteroaryl benzamides, compositions and methods of use | 20090721 |
WO-2011011514-A1 | Heteroaryl benzamides, compositions and methods of use | 20090721 |
TW-200536527-A | PPAR active compounds | 20040312 |
JP-2006510724-A | Bis-arylsulfonamide | 20021118 |
CA-2472469-A1 | 1,3-disubstituted and 1,3,3,-trisubstituted pyrrolidines as histamine-3 receptor ligands and their therapeutic applications | 20020111 |
Complexity: | 271 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 248.0273931 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 248.0273931 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 51.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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