Methyl 6-Chloro-2-pyrazinecarboxylate - CAS 23611-75-8
Catalog: |
BB018112 |
Product Name: |
Methyl 6-Chloro-2-pyrazinecarboxylate |
CAS: |
23611-75-8 |
Synonyms: |
6-chloro-2-pyrazinecarboxylic acid methyl ester; methyl 6-chloropyrazine-2-carboxylate |
IUPAC Name: | methyl 6-chloropyrazine-2-carboxylate |
Description: | Methyl 6-Chloro-2-pyrazinecarboxylate (CAS# 23611-75-8) is a useful research chemical. |
Molecular Weight: | 172.57 |
Molecular Formula: | C6H5ClN2O2 |
Canonical SMILES: | COC(=O)C1=CN=CC(=N1)Cl |
InChI: | InChI=1S/C6H5ClN2O2/c1-11-6(10)4-2-8-3-5(7)9-4/h2-3H,1H3 |
InChI Key: | MVVYUJFEXRODQA-UHFFFAOYSA-N |
Boiling Point: | 256.437 °C at 760 mmHg |
Density: | 1.373 g/cm3 |
MDL: | MFCD10686598 |
LogP: | 0.91660 |
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-2021127397-A1 | Nitrogen heterocyclic compounds and methods of use | 20191219 |
WO-2020178782-A1 | Modulators of ampa receptor signaling | 20190305 |
WO-2019154363-A1 | Prostacyclin receptor agonist | 20180207 |
EP-3750879-A1 | Prostacyclin receptor agonist | 20180207 |
US-2021087168-A1 | Prostacyclin receptor agonist | 20180207 |
Complexity: | 154 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 172.0039551 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 172.0039551 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 52.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.5 |
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