| CAS Number | 1094537-02-6 |
| Catalog Number | AG01AGKF |
| Chemical Name | 4-(Propan-2-yloxy)naphthalene-1-sulfonamide |
| IUPAC Name | 4-propan-2-yloxynaphthalene-1-sulfonamide |
| InChI | InChI=1S/C13H15NO3S/c1-9(2)17-12-7-8-13(18(14,15)16)11-6-4-3-5-10(11)12/h3-9H,1-2H3,(H2,14,15,16) |
| InChI Key | MVHXFCVNQQZSBC-UHFFFAOYSA-N |
| MDL Number | MFCD11213117 |
| Molecular Formula | C13H15NO3S |
| Molecular Weight | 265.3281 |
| SMILES | CC(OC1=C2C(C=CC=C2)=C(S(N)(=O)=O)C=C1)C |
| Synonyms | 4-(propan-2-yloxy)naphthalene-1-sulfonamide,
1094537-02-6,
AC1Q1QMT,
ZINC30290583,
AKOS009344189,
MCULE-5907911762,
NE15137,
EN300-72115,
Z394672484,
|
| Complexity | 374 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 265.077g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 265.327g/mol |
| Monoisotopic Mass | 265.077g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 77.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number