6-Bromo-4-chloro-2,8-dimethylquinoline - CAS 1153002-90-4
Catalog: |
BB003542 |
Product Name: |
6-Bromo-4-chloro-2,8-dimethylquinoline |
CAS: |
1153002-90-4 |
Synonyms: |
6-bromo-4-chloro-2,8-dimethylquinoline |
IUPAC Name: | 6-bromo-4-chloro-2,8-dimethylquinoline |
Description: | 6-Bromo-4-chloro-2,8-dimethylquinoline (CAS# 1153002-90-4) is a useful research chemical. |
Molecular Weight: | 270.55 |
Molecular Formula: | C11H9BrClN |
Canonical SMILES: | CC1=C2C(=CC(=C1)Br)C(=CC(=N2)C)Cl |
InChI: | InChI=1S/C11H9BrClN/c1-6-3-8(12)5-9-10(13)4-7(2)14-11(6)9/h3-5H,1-2H3 |
InChI Key: | YJTIVPXNBMXIJP-UHFFFAOYSA-N |
Purity: | 95 % |
MDL: | MFCD12114952 |
LogP: | 4.26750 |
GHS Hazard Statement: | H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]; H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard] |
Precautionary Statement: | P264, P270, P273, P301+P316, P321, P330, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
JP-2020528447-A | Compounds that specifically bind to CD38 for use in the treatment of neurodegenerative and inflammatory diseases | 20170724 |
WO-2016022626-A1 | Heterocyclic cgrp receptor antagonists | 20140806 |
WO-2016022644-A1 | Heterocyclic cgrp receptor antagonists | 20140806 |
WO-2016022645-A1 | Heterocyclic cgrp receptor antagonists | 20140806 |
Complexity: | 212 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 268.96069 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 268.96069 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 12.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.3 |
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