2,6-Dichloro-8-methylquinoline-3-carboxaldehyde - CAS 938138-94-4
Catalog: |
BB041090 |
Product Name: |
2,6-Dichloro-8-methylquinoline-3-carboxaldehyde |
CAS: |
938138-94-4 |
Synonyms: |
2,6-dichloro-8-methylquinoline-3-carbaldehyde |
IUPAC Name: | 2,6-dichloro-8-methylquinoline-3-carbaldehyde |
Description: | 2,6-Dichloro-8-methylquinoline-3-carboxaldehyde (CAS# 938138-94-4) is a useful research chemical. |
Molecular Weight: | 240.09 |
Molecular Formula: | C11H7Cl2NO |
Canonical SMILES: | CC1=CC(=CC2=CC(=C(N=C12)Cl)C=O)Cl |
InChI: | InChI=1S/C11H7Cl2NO/c1-6-2-9(12)4-7-3-8(5-15)11(13)14-10(6)7/h2-5H,1H3 |
InChI Key: | LQGCPWAESLYAKC-UHFFFAOYSA-N |
Boiling Point: | 375.3 °C at 760 mmHg |
Density: | 1.423 g/cm3 |
LogP: | 3.66250 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P317, P330, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
AU-2016336437-A1 | Compounds, compositions, and methods for modulating CFTR | 20151006 |
AU-2016336437-B2 | Compounds, compositions, and methods for modulating CFTR | 20151006 |
CA-3000483-A1 | Compounds, compositions, and methods for modulating cftr | 20151006 |
EP-3359536-A1 | Compounds, compositions, and methods for modulating cftr | 20151006 |
JP-2018537413-A | Compounds, compositions and methods for modulating CFTR | 20151006 |
Complexity: | 249 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 238.9904692 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 238.9904692 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 30 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.6 |
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Quinoline/Isoquinoline
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