2-Chloro-4-pyridinecarboxaldehyde - CAS 101066-61-9
Catalog: |
BB000428 |
Product Name: |
2-Chloro-4-pyridinecarboxaldehyde |
CAS: |
101066-61-9 |
Synonyms: |
2-chloropyridine-4-carbaldehyde |
IUPAC Name: | 2-chloropyridine-4-carbaldehyde |
Description: | 2-Chloro-4-pyridinecarboxaldehyde (CAS# 101066-61-9) is a reagent used in the chemoenzymic synthesis of α-fluoro β-hydroxy carboxylic esters. It is also a reagent in the combinatorial synthesis of methylene sulfonamides and related compounds as potential kinase inhibitors. |
Molecular Weight: | 141.56 |
Molecular Formula: | C6H4ClNO |
Canonical SMILES: | C1=CN=C(C=C1C=O)Cl |
InChI: | InChI=1S/C6H4ClNO/c7-6-3-5(4-9)1-2-8-6/h1-4H |
InChI Key: | UFPOSTQMFOYHJI-UHFFFAOYSA-N |
Boiling Point: | 243.4 °C at 760 mmHg |
Purity: | 97.0 % |
Density: | 1.332 g/cm3 |
Appearance: | White crystalline powder |
MDL: | MFCD06651557 |
LogP: | 1.54750 |
GHS Hazard Statement: | H302 (88.64%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P272, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P333+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021198283-A1 | Inhibitors of antigen presentation by hla-dr | 20200331 |
WO-2021197276-A1 | Amide compounds and uses thereof | 20200330 |
WO-2021068179-A1 | Novel heteroaryl-substituted pyrazine derivatives as pesticides | 20191011 |
WO-2021071821-A1 | Arylmethylene aromatic compounds as kv1.3 potassium shaker channel blockers | 20191007 |
WO-2021022215-A1 | Inhibitors of advanced glycation end products | 20190801 |
Complexity: | 107 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 140.9981414 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 140.9981414 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 30 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Customers Also Viewed
INDUSTRY LEADERS TRUST OUR PRODUCTS