4-Chloroquinaldine - CAS 4295-06-1
Catalog: |
BB025288 |
Product Name: |
4-Chloroquinaldine |
CAS: |
4295-06-1 |
Synonyms: |
4-chloro-2-methylquinoline |
IUPAC Name: | 4-chloro-2-methylquinoline |
Description: | 4-Chloroquinaldine (CAS# 4295-06-1) is a reagent used in the synthesis of 9-anilinoacridine and 4-anilinoquinoline derivatives as antioxidants and antitumor agents. |
Molecular Weight: | 177.63 |
Molecular Formula: | C10H8ClN |
Canonical SMILES: | CC1=NC2=CC=CC=C2C(=C1)Cl |
InChI: | InChI=1S/C10H8ClN/c1-7-6-9(11)8-4-2-3-5-10(8)12-7/h2-6H,1H3 |
InChI Key: | HQAIROMRVBVWSK-UHFFFAOYSA-N |
Boiling Point: | 269 °C |
Melting Point: | 39-270 °C |
Purity: | 95 % |
Density: | 0.881 g/cm3 |
MDL: | MFCD00006757 |
LogP: | 3.19660 |
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 |
Publication Number | Title | Priority Date |
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Complexity: | 160 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 177.0345270 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 177.0345270 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 12.9 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.5 |
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