Methyl 3-Chloropyridine-4-carboxylate - CAS 98273-79-1
Catalog: |
BB042130 |
Product Name: |
Methyl 3-Chloropyridine-4-carboxylate |
CAS: |
98273-79-1 |
Synonyms: |
3-chloro-4-pyridinecarboxylic acid methyl ester; methyl 3-chloropyridine-4-carboxylate |
IUPAC Name: | methyl 3-chloropyridine-4-carboxylate |
Description: | Methyl 3-Chloropyridine-4-carboxylate (CAS# 98273-79-1) is a useful research chemical. |
Molecular Weight: | 171.58 |
Molecular Formula: | C7H6ClNO2 |
Canonical SMILES: | COC(=O)C1=C(C=NC=C1)Cl |
InChI: | InChI=1S/C7H6ClNO2/c1-11-7(10)5-2-3-9-4-6(5)8/h2-4H,1H3 |
InChI Key: | UWSWHAPVUHNFKD-UHFFFAOYSA-N |
Boiling Point: | 232.9 °C at 760 mmHg |
Density: | 1.294 g/cm3 |
Storage: | Inert atmosphere, 2-8 °C |
LogP: | 1.52160 |
Publication Number | Title | Priority Date |
EA-034781-B1 | Aryl, heteroaryl and heterocyclic compounds for the treatment of disorder mediated by complement factor D | 20150826 |
TW-201922746-A | 2-(morpholin-4-yl)-1,7-naphthyridine | 20140804 |
TW-I700283-B | 2-(morpholin-4-yl)-1,7-naphthyridines | 20140804 |
CN-104974175-A | Preparation method of aminomethyl hydroxyisooxazole analogue | 20140411 |
AU-2013351550-A1 | Specific carboxamides as KCNQ2/3 modulators | 20121128 |
Complexity: | 151 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 171.0087061 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 171.0087061 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 39.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.3 |
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