Ethyl 6-Chloropyrimidine-4-carboxylate - CAS 51940-63-7
Catalog: |
BB027655 |
Product Name: |
Ethyl 6-Chloropyrimidine-4-carboxylate |
CAS: |
51940-63-7 |
Synonyms: |
6-chloro-4-pyrimidinecarboxylic acid ethyl ester; ethyl 6-chloropyrimidine-4-carboxylate |
IUPAC Name: | ethyl 6-chloropyrimidine-4-carboxylate |
Description: | Ethyl 6-Chloropyrimidine-4-carboxylate (CAS# 51940-63-7) is a useful research chemical. |
Molecular Weight: | 186.60 |
Molecular Formula: | C7H7ClN2O2 |
Canonical SMILES: | CCOC(=O)C1=CC(=NC=N1)Cl |
InChI: | InChI=1S/C7H7ClN2O2/c1-2-12-7(11)5-3-6(8)10-4-9-5/h3-4H,2H2,1H3 |
InChI Key: | DSNWMSGZYSQPTE-UHFFFAOYSA-N |
LogP: | 1.30670 |
Publication Number | Title | Priority Date |
WO-2021211741-A1 | Substituted pyridines for the treatment of inflammatory diseases | 20200414 |
AU-2015289492-A1 | Methods and compositions for treating HIV-related disorders | 20140717 |
AU-2015289492-B2 | Methods and compositions for treating HIV-related disorders | 20140717 |
CA-2955379-A1 | Methods and compositions for treating hiv-related disorders | 20140717 |
EA-034528-B1 | METHOD FOR TREATING HIV DISORDERS | 20140717 |
Complexity: | 166 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 186.0196052 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 186.0196052 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 52.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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