| CAS Number | 364794-57-0 |
| Catalog Number | AG00CLOB(AGN-PC-04370X) |
| Chemical Name | 5-Bromo-2-(4-ethylpiperidino)pyridine |
| IUPAC Name | 1-(5-bromopyridin-2-yl)-4-ethylpiperazine |
| InChI | InChI=1S/C11H16BrN3/c1-2-14-5-7-15(8-6-14)11-4-3-10(12)9-13-11/h3-4,9H,2,5-8H2,1H3 |
| InChI Key | UPRFWTJUNHFOKG-UHFFFAOYSA-N |
| MDL Number | MFCD09910224 |
| Molecular Formula | C11H16BrN3 |
| Molecular Weight | 270.1688 |
| SMILES | CCN1CCN(CC1)c1ccc(cn1)Br |
| Synonyms | 364794-57-0,
1-(5-Bromopyridin-2-yl)-4-ethylpiperazine,
1-(5-Bromo-2-pyridinyl)-4-ethylpiperazine,
SCHEMBL4010339,
CTK4H6533,
DTXSID80634140,
MFCD09910224,
ZINC26898955,
AM86908,
AJ-83251,
FT-0648555,
A-3325,
B67492,
1-(5-BROMO-PYRIDIN-2-YL)-4-ETHYLPIPERAZINE,
5-Bromo-2-(4-ethylpiperidino)pyridine,
|
| Complexity | 192 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 269.053g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 270.174g/mol |
| Monoisotopic Mass | 269.053g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 19.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number