| CAS Number | 1060802-24-5 |
| Catalog Number | AG00HAR0(AGN-PC-0WQXJ9) |
| Chemical Name | 5-Bromo-4-chloronicotinaldehyde |
| IUPAC Name | 5-bromo-4-chloropyridine-3-carbaldehyde |
| InChI | InChI=1S/C6H3BrClNO/c7-5-2-9-1-4(3-10)6(5)8/h1-3H |
| InChI Key | LSNBFATWINWCAX-UHFFFAOYSA-N |
| MDL Number | MFCD13189052 |
| Molecular Formula | C6H3BrClNO |
| Molecular Weight | 220.4511 |
| SMILES | O=CC1=C(Cl)C(Br)=CN=C1 |
| Synonyms | 5-BROMO-4-CHLORONICOTINALDEHYDE,
1060802-24-5,
5-bromo-4-chloropyridine-3-carbaldehyde,
SCHEMBL6118301,
DTXSID40857212,
LSNBFATWINWCAX-UHFFFAOYSA-N,
MFCD13189052,
ZINC91691983,
AKOS027253430,
AB67643,
AS-38374,
SY221787,
3-Pyridinecarboxaldehyde, 5-bromo-4-chloro-,
MFCD13189052 (95%),
5-BROMO-4-CHLORO-PYRIDINE-3-CARBALDEHYDE,
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| Complexity | 133 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 218.909g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 220.45g/mol |
| Monoisotopic Mass | 218.909g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 30A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number