6-Chloro-8-methylquinoline-3-carboxylic acid - CAS 948289-56-3
Catalog: |
BB041519 |
Product Name: |
6-Chloro-8-methylquinoline-3-carboxylic acid |
CAS: |
948289-56-3 |
Synonyms: |
6-chloro-8-methylquinoline-3-carboxylic acid |
IUPAC Name: | 6-chloro-8-methylquinoline-3-carboxylic acid |
Description: | 6-Chloro-8-methylquinoline-3-carboxylic acid (CAS# 948289-56-3) is a useful research chemical. |
Molecular Weight: | 221.64 |
Molecular Formula: | C11H8ClNO2 |
Canonical SMILES: | CC1=CC(=CC2=CC(=CN=C12)C(=O)O)Cl |
InChI: | InChI=1S/C11H8ClNO2/c1-6-2-9(12)4-7-3-8(11(14)15)5-13-10(6)7/h2-5H,1H3,(H,14,15) |
InChI Key: | AZUBVKRZQUUAAX-UHFFFAOYSA-N |
Boiling Point: | 397.5 °C at 760 mmHg |
Density: | 1.406 g/cm3 |
LogP: | 2.89480 |
Publication Number | Title | Priority Date |
US-2011190342-A1 | Glycine b antagonist | 20080930 |
US-8288549-B2 | Glycine B antagonist | 20080930 |
Complexity: | 259 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 221.0243562 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 221.0243562 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 50.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
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