6-Chloro-5-nitroquinoline - CAS 86984-32-9
Catalog: |
BB038155 |
Product Name: |
6-Chloro-5-nitroquinoline |
CAS: |
86984-32-9 |
Synonyms: |
6-chloro-5-nitroquinoline; 6-chloro-5-nitroquinoline |
IUPAC Name: | 6-chloro-5-nitroquinoline |
Description: | 6-Chloro-5-nitroquinoline (CAS# 86984-32-9) is a useful research chemical. |
Molecular Weight: | 208.60 |
Molecular Formula: | C9H5ClN2O2 |
Canonical SMILES: | C1=CC2=C(C=CC(=C2[N+](=O)[O-])Cl)N=C1 |
InChI: | InChI=1S/C9H5ClN2O2/c10-7-3-4-8-6(2-1-5-11-8)9(7)12(13)14/h1-5H |
InChI Key: | GIMHFTJFCRTQRS-UHFFFAOYSA-N |
Boiling Point: | 356.7 °C at 760 mmHg |
Density: | 1.484 g/cm3 |
MDL: | MFCD00093616 |
LogP: | 3.31960 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P310, 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 |
CN-107952425-B | Preparation method of antitumor drug NVP-BEZ235 intermediate | 20171227 |
AU-2008248201-A1 | Compounds as CRTH2 and/or PGD2 receptors modulators and their use for treating asthma and allergic inflammation | 20070502 |
AU-2008248201-B2 | Compounds as CRTH2 and/or PGD2 receptors modulators and their use for treating asthma and allergic inflammation | 20070502 |
CA-2685215-A1 | Compounds and methods useful for treating asthma and allergic inflammation | 20070502 |
CA-2685215-C | Compounds and methods useful for treating asthma and allergic inflammation | 20070502 |
Complexity: | 231 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 208.0039551 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 208.0039551 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 58.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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