Ethyl 6-chloropyridine-3-carboxylate - CAS 49608-01-7
Catalog: |
BB026748 |
Product Name: |
Ethyl 6-chloropyridine-3-carboxylate |
CAS: |
49608-01-7 |
Synonyms: |
ethyl 6-chloropyridine-3-carboxylate |
IUPAC Name: | ethyl 6-chloropyridine-3-carboxylate |
Description: | Ethyl 6-chloropyridine-3-carboxylate (CAS# 49608-01-7) is a nicotinic acid derivative used in the preparation of potent H3 receptor antagonists. |
Molecular Weight: | 185.61 |
Molecular Formula: | C8H8ClNO2 |
Canonical SMILES: | CCOC(=O)C1=CN=C(C=C1)Cl |
InChI: | InChI=1S/C8H8ClNO2/c1-2-12-8(11)6-3-4-7(9)10-5-6/h3-5H,2H2,1H3 |
InChI Key: | ILDJJTQWIZLGPO-UHFFFAOYSA-N |
Boiling Point: | 249.2 °C at 760 mmHg |
Purity: | > 97.0 % (GC) |
Density: | 1.245 g/cm3 |
MDL: | MFCD00082739 |
LogP: | 1.91170 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021188936-A1 | Phd inhibitor compounds, compositions, and use | 20200320 |
WO-2021126693-A1 | Gem-disubstituted piperidine melanocortin subtype-2 receptor (mc2r) antagonists and uses thereof | 20191218 |
WO-2021071832-A1 | Aryl heterobicyclic compounds as kv1.3 potassium shaker channel blockers | 20191007 |
CN-110551067-A | Multi-target tacrine derivative and preparation method and application thereof | 20190919 |
CN-110551067-B | Multi-target tacrine derivative and preparation method and application thereof | 20190919 |
Complexity: | 163 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 185.0243562 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 185.0243562 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 39.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
Online Inquiry
Customer Support
Customer Centered
Related Functional Groups
Carbonyl Compounds
Pyridines
Customers Also Viewed
-
[14245-62-6]
Isopropyl ethanesulfonate
-
[35045-02-4]
Metribuzin-desamino
-
[2482-00-0]
Agmatine sulfate salt
-
[582-16-1]
2,7-Dimethylnaphthalene
-
[132182-92-4]
Pentane, 1,1,1,2,2,3,4,5,5,5-decafluoro-3-methoxy-4-(trifluoromethyl)-
-
[1643-20-5]
N,N-dimethyldodecan-1-amine oxide
INDUSTRY LEADERS TRUST OUR PRODUCTS