| CAS Number | 936497-82-4 |
| Catalog Number | AG00GSMT(AGN-PC-0WCR0X) |
| Chemical Name | 8-bromo-4-chloro-quinoline-3-carbonitrile |
| IUPAC Name | 8-bromo-4-chloroquinoline-3-carbonitrile |
| InChI | InChI=1S/C10H4BrClN2/c11-8-3-1-2-7-9(12)6(4-13)5-14-10(7)8/h1-3,5H |
| InChI Key | QHLROYHGQHENCI-UHFFFAOYSA-N |
| MDL Number | MFCD09261319 |
| Molecular Formula | C10H4BrClN2 |
| Molecular Weight | 267.5092 |
| SMILES | ClC1=C2C(C(=CC=C2)Br)=NC=C1C#N |
| Synonyms | 8-Bromo-4-chloro-quinoline-3-carbonitrile,
936497-82-4,
8-bromo-4-chloroquinoline-3-carbonitrile,
MFCD09261319,
ZINC16697137,
AKOS000177848,
BBV-070259,
FCH5040091,
AS-36935,
EN300-198914,
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| Complexity | 262 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 265.925g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 267.51g/mol |
| Monoisotopic Mass | 265.925g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 36.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number