| CAS Number | 1203579-29-6 |
| Catalog Number | AG00935J(AGN-PC-0WR1NW) |
| Chemical Name | 3-Bromo-4-chloro-6-methoxyquinoline |
| IUPAC Name | 3-bromo-4-chloro-6-methoxyquinoline |
| InChI | InChI=1S/C10H7BrClNO/c1-14-6-2-3-9-7(4-6)10(12)8(11)5-13-9/h2-5H,1H3 |
| InChI Key | JPJOZOXSMAFCSD-UHFFFAOYSA-N |
| MDL Number | MFCD13192951 |
| Molecular Formula | C10H7BrClNO |
| Molecular Weight | 272.5257 |
| SMILES | COC2=CC=C1N=CC(Br)=C(Cl)C1=C2 |
| Synonyms | 3-Bromo-4-chloro-6-methoxyquinoline,
1203579-29-6,
DTXSID90671162,
MFCD13192951,
ZINC41702279,
FT-0708431,
T6267,
3-Bromo-4-chloro-6-methoxyquinoline, AldrichCPR,
|
| Complexity | 205 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 270.94g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 272.526g/mol |
| Monoisotopic Mass | 270.94g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 22.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
GHS Hazard and Precautionary Statements
| Symbol: |   |
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Hazard Class
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\N
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Hazard statements
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H301-H318
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Packing Group
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|
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Precautionary statements
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P280-P301+P310-P305+P351+P338
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UN Code
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\N
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Certificate of Analysis
Lot Number