| CAS Number | 926254-20-8 |
| Catalog Number | AG00JVF2(AGN-PC-0WOPJ5) |
| Chemical Name | 1-(2-Ethoxybenzoyl)piperazine |
| IUPAC Name | (2-ethoxyphenyl)-piperazin-1-ylmethanone |
| InChI | InChI=1S/C13H18N2O2/c1-2-17-12-6-4-3-5-11(12)13(16)15-9-7-14-8-10-15/h3-6,14H,2,7-10H2,1H3 |
| InChI Key | WPWMCYXQEOHPMU-UHFFFAOYSA-N |
| MDL Number | MFCD08442725 |
| Molecular Formula | C13H18N2O2 |
| Molecular Weight | 234.2942 |
| SMILES | CCOC1=C(C(N2CCNCC2)=O)C=CC=C1 |
| Synonyms | 1-(2-ethoxybenzoyl)piperazine,
1-[(2-ethoxyphenyl)carbonyl]piperazine,
926254-20-8,
AC1Q35IR,
CTK6G2901,
KS-00001NUO,
MFCD08442725,
ZINC21952010,
AKOS000125694,
MCULE-2622101716,
NE31893,
(2-Ethoxyphenyl)(piperazin-1-yl)methanone,
EN300-43596,
|
| Complexity | 252 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 234.137g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 234.299g/mol |
| Monoisotopic Mass | 234.137g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 41.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number