| CAS Number | 517855-83-3 |
| Catalog Number | AG01AARJ |
| Chemical Name | 1-[1-(2-methoxyphenyl)ethyl]piperazine |
| IUPAC Name | 1-[1-(2-methoxyphenyl)ethyl]piperazine |
| InChI | InChI=1S/C13H20N2O/c1-11(15-9-7-14-8-10-15)12-5-3-4-6-13(12)16-2/h3-6,11,14H,7-10H2,1-2H3 |
| InChI Key | SCYBWJSKOWKSRR-UHFFFAOYSA-N |
| MDL Number | MFCD05187299 |
| Molecular Formula | C13H20N2O |
| Molecular Weight | 220.3107 |
| SMILES | COC1=C(C(N2CCNCC2)C)C=CC=C1 |
| Synonyms | 1-[1-(2-methoxyphenyl)ethyl]piperazine,
517855-83-3,
AC1N0BUN,
AC1Q44ZX,
SCHEMBL335012,
AKOS008143145,
MCULE-9011384495,
NE53817,
1-(2-Methoxy-2-phenyl)-ethylpiperazin,
EN300-69379,
1-[1-(2-methoxyphenyl)ethyl]piperazine, AldrichCPR,
Z1263811682,
CID3935315,
1-[1-(2-Methoxy-phenyl)-ethyl]-piperazine,
|
| Complexity | 204 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 220.158g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 220.316g/mol |
| Monoisotopic Mass | 220.158g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 24.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number