2-Amino-5-chloronicotinic Acid - CAS 52833-93-9
Catalog: |
BB027960 |
Product Name: |
2-Amino-5-chloronicotinic Acid |
CAS: |
52833-93-9 |
Synonyms: |
2-amino-5-chloro-3-pyridinecarboxylic acid; 2-amino-5-chloropyridine-3-carboxylic acid |
IUPAC Name: | 2-amino-5-chloropyridine-3-carboxylic acid |
Description: | 2-Amino-5-chloronicotinic Acid (CAS# 52833-93-9) is a useful research chemical. |
Molecular Weight: | 172.57 |
Molecular Formula: | C6H5ClN2O2 |
Canonical SMILES: | C1=C(C(=NC=C1Cl)N)C(=O)O |
InChI: | InChI=1S/C6H5ClN2O2/c7-3-1-4(6(10)11)5(8)9-2-3/h1-2H,(H2,8,9)(H,10,11) |
InChI Key: | FYVCCMWINPVVOB-UHFFFAOYSA-N |
Boiling Point: | 353.1 °C at 760 mmHg |
Density: | 1.577 g/cm3 |
MDL: | MFCD09839254 |
LogP: | 1.59660 |
Publication Number | Title | Priority Date |
US-2021078975-A1 | Fused cyclic urea derivatives as crhr2 antagonist | 20180409 |
AU-2016317806-A1 | Heteroaryl compounds and their use as therapeutic drugs | 20150831 |
CA-2995675-A1 | Heteroaryl compounds and their use as therapeutic drugs | 20150831 |
EP-3344613-A1 | Heteroaryl compounds and their use as therapeutic drugs | 20150831 |
EP-3344613-B1 | Heteroaryl compounds and their use as therapeutic drugs | 20150831 |
Complexity: | 165 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 172.0039551 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 172.0039551 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 76.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.2 |
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