| CAS Number | 1146089-82-8 |
| Catalog Number | AG000ETL(AGN-PC-0WCYQL) |
| Chemical Name | 5-(Azetidin-3-yloxy)-2-bromopyridine |
| IUPAC Name | 5-(azetidin-3-yloxy)-2-bromopyridine |
| InChI | InChI=1S/C8H9BrN2O/c9-8-2-1-6(5-11-8)12-7-3-10-4-7/h1-2,5,7,10H,3-4H2 |
| InChI Key | GWOLQNDRROKIBR-UHFFFAOYSA-N |
| MDL Number | MFCD22690537 |
| Molecular Formula | C8H9BrN2O |
| Molecular Weight | 229.0739 |
| SMILES | BrC1=NC=C(OC2CNC2)C=C1 |
| Synonyms | 5-(AZETIDIN-3-YLOXY)-2-BROMOPYRIDINE,
1146089-82-8,
SCHEMBL13024264,
MFCD22690537,
ZINC91692828,
FCH2309365,
AS-41224,
Pyridine, 5-(3-azetidinyloxy)-2-bromo-,
AX8267064,
X-2363,
|
| Complexity | 152 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 227.99g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 229.077g/mol |
| Monoisotopic Mass | 227.99g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 34.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P280-P301+P312-P302+P352-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number