7-Chloro-4-iodoquinoline - CAS 98591-57-2
Catalog: |
BB042193 |
Product Name: |
7-Chloro-4-iodoquinoline |
CAS: |
98591-57-2 |
Synonyms: |
7-chloro-4-iodoquinoline |
IUPAC Name: | 7-chloro-4-iodoquinoline |
Description: | 7-Chloro-4-iodoquinoline (CAS# 98591-57-2) is used as a quinolinic-isoquinolinic derivative for acting as reversible electrochromes. |
Molecular Weight: | 289.50 |
Molecular Formula: | C9H5ClIN |
Canonical SMILES: | C1=CC2=C(C=CN=C2C=C1Cl)I |
InChI: | InChI=1S/C9H5ClIN/c10-6-1-2-7-8(11)3-4-12-9(7)5-6/h1-5H |
InChI Key: | HUTDAIDVAMQWDX-UHFFFAOYSA-N |
Boiling Point: | 354.8 °C at 760 mmHg |
Density: | 1.919 g/cm3 |
MDL: | MFCD06798120 |
LogP: | 3.49280 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2021092525-A1 | Wdr5 inhibitors and modulators | 20191108 |
WO-2021035101-A1 | Molecules that bind to tdp-43 for the treatment of amyotrophic lateral sclerosis and related disorders | 20190822 |
AU-2017269256-A1 | Aminoacylindazole immunomodulators for treatment of autoimmune diseases | 20160523 |
CA-3025810-A1 | Aminoacylindazole immunomodulators for treatment of autoimmune diseases | 20160523 |
EP-3463341-A1 | Aminoacylindazole immunomodulators for treatment of autoimmune diseases | 20160523 |
Complexity: | 165 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 288.91552 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 288.91552 |
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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Related Functional Groups
Quinoline/Isoquinoline
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