2-Chloro-6-methylquinoline-3-carboxaldehyde - CAS 73568-27-1
Catalog: |
BB034868 |
Product Name: |
2-Chloro-6-methylquinoline-3-carboxaldehyde |
CAS: |
73568-27-1 |
Synonyms: |
2-chloro-6-methylquinoline-3-carbaldehyde |
IUPAC Name: | 2-chloro-6-methylquinoline-3-carbaldehyde |
Description: | 2-Chloro-6-methylquinoline-3-carboxaldehyde (CAS# 73568-27-1) is a compound useful in organic synthesis. |
Molecular Weight: | 205.64 |
Molecular Formula: | C11H8ClNO |
Canonical SMILES: | CC1=CC2=CC(=C(N=C2C=C1)Cl)C=O |
InChI: | InChI=1S/C11H8ClNO/c1-7-2-3-10-8(4-7)5-9(6-14)11(12)13-10/h2-6H,1H3 |
InChI Key: | FSLNYYZJXMGKHK-UHFFFAOYSA-N |
Boiling Point: | 350.8 °C at 760 mmHg |
Density: | 1.312 g/cm3 |
Appearance: | Solid |
MDL: | MFCD01912773 |
LogP: | 3.00910 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
21589051 | 20101020 | N,N-Bis[(2-chloro-6-methyl-quinolin-3-yl)methyl-idene]ethane-1,2-diamine | Acta crystallographica. Section E, Structure reports online |
21580606 | 20100306 | (2E)-3-(2-Chloro-6-methyl-3-quinol-yl)-1-(1-naphth-yl)prop-2-en-1-one | Acta crystallographica. Section E, Structure reports online |
21580589 | 20100303 | (E)-3-(2-Chloro-6-methyl-3-quinol-yl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)prop-2-en-1-one | Acta crystallographica. Section E, Structure reports online |
21578292 | 20091010 | 2-Chloro-6-methyl-quinoline-3-carbaldehyde | Acta crystallographica. Section E, Structure reports online |
18838772 | 20081001 | Novel chalcones derived from 2-chloro-3-formyl-6-methylquinoline | Acta crystallographica. Section C, Crystal structure communications |
Complexity: | 221 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 205.0294416 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 205.0294416 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 30 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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