4-Chloro-7-azaindole-5-carboxylic Acid - CAS 920966-03-6
Catalog: |
BB040426 |
Product Name: |
4-Chloro-7-azaindole-5-carboxylic Acid |
CAS: |
920966-03-6 |
Synonyms: |
4-chloro-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid; 4-chloro-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid |
IUPAC Name: | 4-chloro-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid |
Description: | 4-Chloro-7-azaindole-5-carboxylic Acid (CAS# 920966-03-6) is a useful research chemical. |
Molecular Weight: | 196.59 |
Molecular Formula: | C8H5ClN2O2 |
Canonical SMILES: | C1=CNC2=NC=C(C(=C21)Cl)C(=O)O |
InChI: | InChI=1S/C8H5ClN2O2/c9-6-4-1-2-10-7(4)11-3-5(6)8(12)13/h1-3H,(H,10,11)(H,12,13) |
InChI Key: | SJZMFAGWKZNYPX-UHFFFAOYSA-N |
Density: | 1.644 g/cm3 |
MDL: | MFCD10574983 |
LogP: | 1.91450 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021151014-A1 | Pgdh inhibitors and methods of making and using | 20200123 |
WO-2021122906-A1 | Anthelmintic compounds comprising azaindoles structure | 20191218 |
KR-20210058153-A | Novel pyrimidine sulfonamide derivatives and a mite controlling composition comprising thereof | 20191113 |
WO-2020242204-A1 | Jak inhibitor compound and pharmaceutical composition containing same | 20190527 |
KR-20200136191-A | Jak inhibitor compounds, and pharmaceutical composition comprising the same | 20190527 |
Complexity: | 224 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 196.0039551 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 196.0039551 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 66 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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