4-Chloro-2-methoxynicotinic Acid - CAS 605661-81-2
Catalog: |
BB030737 |
Product Name: |
4-Chloro-2-methoxynicotinic Acid |
CAS: |
605661-81-2 |
Synonyms: |
4-chloro-2-methoxy-3-pyridinecarboxylic acid; 4-chloro-2-methoxypyridine-3-carboxylic acid |
IUPAC Name: | 4-chloro-2-methoxypyridine-3-carboxylic acid |
Description: | 4-Chloro-2-methoxynicotinic Acid (CAS# 605661-81-2) is a useful research chemical. |
Molecular Weight: | 187.58 |
Molecular Formula: | C7H6ClNO3 |
Canonical SMILES: | COC1=NC=CC(=C1C(=O)O)Cl |
InChI: | InChI=1S/C7H6ClNO3/c1-12-6-5(7(10)11)4(8)2-3-9-6/h2-3H,1H3,(H,10,11) |
InChI Key: | UEVADXSCNZVVQF-UHFFFAOYSA-N |
LogP: | 1.44180 |
Publication Number | Title | Priority Date |
US-2003212061-A1 | Aza-thioxanthenones with antitumor activity | 20020312 |
US-2003225069-A1 | Aza-benzothiopyranoindazoles with antitumor activity | 20020312 |
US-6747039-B2 | Aza-benzothiopyranoindazoles with antitumor activity | 20020312 |
Complexity: | 176 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 187.0036207 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 187.0036207 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 59.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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