| CAS Number | 1049023-41-7 |
| Catalog Number | AG008Z1C(AGN-PC-0WAN0K) |
| Chemical Name | 4-(2-Bromopyridin-4-yl)morpholine |
| IUPAC Name | 4-(2-bromopyridin-4-yl)morpholine |
| InChI | InChI=1S/C9H11BrN2O/c10-9-7-8(1-2-11-9)12-3-5-13-6-4-12/h1-2,7H,3-6H2 |
| InChI Key | JCRVQCRLFOBEPW-UHFFFAOYSA-N |
| MDL Number | MFCD11869654 |
| Molecular Formula | C9H11BrN2O |
| Molecular Weight | 243.1004 |
| SMILES | BrC1=NC=CC(N2CCOCC2)=C1 |
| Synonyms | 4-(2-bromopyridin-4-yl)morpholine,
1049023-41-7,
SCHEMBL3304237,
DTXSID30671722,
8065AC,
MFCD11869654,
ZINC44118699,
AKOS015945682,
DS-6968,
RL00230,
AK131996,
2-bromo-4-(morpholino)pyridine AldrichCPR,
2-bromo-4-(morpholino)pyridine, AldrichCPR,
4CH-022287,
FT-0719654,
ST24042843,
J-513285,
F0001-0100,
C9H11BrN2O,
|
| Complexity | 162 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 242.005g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 243.104g/mol |
| Monoisotopic Mass | 242.005g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 25.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
6.1
|
|
Hazard statements
|
H317-H319
|
|
Packing Group
|
Ⅲ
|
|
Precautionary statements
|
P280-P305+P351+P338
|
|
UN Code
|
UN 2811
|
Certificate of Analysis
Lot Number