4-Methylfuran-2-carbonyl Chloride - CAS 39272-49-6
Catalog: |
BB023926 |
Product Name: |
4-Methylfuran-2-carbonyl Chloride |
CAS: |
39272-49-6 |
Synonyms: |
4-methyl-2-furancarbonyl chloride; 4-methylfuran-2-carbonyl chloride |
IUPAC Name: | 4-methylfuran-2-carbonyl chloride |
Description: | 4-Methylfuran-2-carbonyl Chloride (CAS# 39272-49-6 ) is a useful research chemical. |
Molecular Weight: | 144.56 |
Molecular Formula: | C6H5ClO2 |
Canonical SMILES: | CC1=COC(=C1)C(=O)Cl |
InChI: | InChI=1S/C6H5ClO2/c1-4-2-5(6(7)8)9-3-4/h2-3H,1H3 |
InChI Key: | DNXMWVZQLPNQQB-UHFFFAOYSA-N |
LogP: | 1.96700 |
Publication Number | Title | Priority Date |
WO-2019145214-A1 | TRIAZOLE, IMIDAZOLE AND PYRROLE CONDENSED PIPERAZINE DERIVATIVES AND THEIR USE AS MODULATORS OF mGlu5 RECEPTORS | 20180126 |
AU-2019212093-A1 | Triazole, imidazole and pyrrole condensed piperazine derivatives and their use as modulators of mGlu5 receptors | 20180126 |
CN-112041319-A | Triazole, imidazole and pyrrole fused piperazine derivatives and their use as mGlu5Use of modulators of receptors | 20180126 |
EP-3743429-A1 | TRIAZOLE, IMIDAZOLE AND PYRROLE CONDENSED PIPERAZINE DERIVATIVES AND THEIR USE AS MODULATORS OF mGlu5 RECEPTORS | 20180126 |
KR-20200120915-A | Triazole, imidazole and pyrrole condensed piperazine derivatives as modulators of mGlu5 receptors and their use | 20180126 |
Complexity: | 124 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 143.9978071 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 143.9978071 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 30.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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