| CAS Number | 949977-30-4 |
| Catalog Number | AG019PJZ |
| Chemical Name | 2-chloro-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]acetamide |
| IUPAC Name | 2-chloro-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]acetamide |
| InChI | InChI=1S/C15H18ClNO3/c16-10-14(18)17-15(5-1-2-6-15)11-3-4-12-13(9-11)20-8-7-19-12/h3-4,9H,1-2,5-8,10H2,(H,17,18) |
| InChI Key | IWGQITPDBXONGR-UHFFFAOYSA-N |
| MDL Number | MFCD09802017 |
| Molecular Formula | C15H18ClNO3 |
| Molecular Weight | 295.7613 |
| SMILES | ClCC(NC1(C2=CC3=C(OCCO3)C=C2)CCCC1)=O |
| Synonyms | 2-chloro-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)cyclopentyl]acetamide,
949977-30-4,
AC1Q3TI2,
CTK6H5286,
ZINC12504961,
AKOS030740560,
MCULE-1937048321,
NE41547,
EN300-24006,
Z235363003,
|
| Complexity | 357 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 295.098g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 295.763g/mol |
| Monoisotopic Mass | 295.098g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 47.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number