| CAS Number | 4295-09-4 |
| Catalog Number | AG00CKXU(AGN-PC-0NISAQ) |
| Chemical Name | 2-Chloro-4-methoxyquinoline |
| IUPAC Name | 2-chloro-4-methoxyquinoline |
| InChI | InChI=1S/C10H8ClNO/c1-13-9-6-10(11)12-8-5-3-2-4-7(8)9/h2-6H,1H3 |
| InChI Key | LVWGQKSYKDQZKF-UHFFFAOYSA-N |
| MDL Number | MFCD10000786 |
| Molecular Formula | C10H8ClNO |
| Molecular Weight | 193.6296 |
| SMILES | COC1=C2C(C=CC=C2)=NC(Cl)=C1 |
| Synonyms | 2-Chloro-4-methoxyquinoline,
4295-09-4,
2-Chloro-4-methoxy-quinoline,
Quinoline, 2-chloro-4-methoxy-,
CHEMBL193905,
quinoline,2-chloro-4-methoxy-,
SCHEMBL2539705,
CTK1D2921,
DTXSID40494722,
LVWGQKSYKDQZKF-UHFFFAOYSA-N,
1654AJ,
MFCD10000786,
ZINC28523280,
AKOS006302854,
AB55891,
AJ-83527,
AS-43141,
Z-6513,
C10H8ClNO,
|
| Complexity | 176 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 193.029g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 193.63g/mol |
| Monoisotopic Mass | 193.029g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 22.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
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-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number