| CAS Number | 864460-68-4 |
| Catalog Number | AG00IE2N(AGN-PC-03EHYD) |
| Chemical Name | 2-Bromo-4-(chloromethyl)pyridine |
| IUPAC Name | 2-bromo-4-(chloromethyl)pyridine |
| InChI | InChI=1S/C6H5BrClN/c7-6-3-5(4-8)1-2-9-6/h1-3H,4H2 |
| InChI Key | WRCMVKYFKWKRIG-UHFFFAOYSA-N |
| MDL Number | MFCD12025164 |
| Molecular Formula | C6H5BrClN |
| Molecular Weight | 206.4676 |
| SMILES | ClCC1=CC(Br)=NC=C1 |
| Synonyms | 2-Bromo-4-(chloromethyl)pyridine,
864460-68-4,
PYRIDINE, 2-BROMO-4-(CHLOROMETHYL)-,
SCHEMBL1940921,
DTXSID80617054,
MFCD12025164,
ZINC95642366,
AKOS022173670,
AB65254,
AK137979,
AS-41737,
SC-57586,
AJ-133407,
PYRIDINE,2-BROMO-4-(CHLOROMETHYL)-,
|
| Complexity | 89.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 204.929g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 206.467g/mol |
| Monoisotopic Mass | 204.929g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H332-H335
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Packing Group
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Precautionary statements
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P280-P305+P351+P338-P310
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UN Code
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Certificate of Analysis
Lot Number