Methyl 6-Chloropyridazine-3-carboxylate - CAS 65202-50-8
Catalog: |
BB032659 |
Product Name: |
Methyl 6-Chloropyridazine-3-carboxylate |
CAS: |
65202-50-8 |
Synonyms: |
6-chloro-3-pyridazinecarboxylic acid methyl ester; methyl 6-chloropyridazine-3-carboxylate |
IUPAC Name: | methyl 6-chloropyridazine-3-carboxylate |
Description: | Methyl 6-Chloropyridazine-3-carboxylate (CAS# 65202-50-8) is a useful research chemical. |
Molecular Weight: | 172.57 |
Molecular Formula: | C6H5ClN2O2 |
Canonical SMILES: | COC(=O)C1=NN=C(C=C1)Cl |
InChI: | InChI=1S/C6H5ClN2O2/c1-11-6(10)4-2-3-5(7)9-8-4/h2-3H,1H3 |
InChI Key: | FPKXYXKLOWAIOX-UHFFFAOYSA-N |
Boiling Point: | 310.939 ℃ at 760 mmHg |
Density: | 1.373 g/cm3 |
MDL: | MFCD08694876 |
LogP: | 0.91660 |
GHS Hazard Statement: | H302 (66.67%): 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 |
US-2021292301-A1 | Heteroaromatic carboxamide derivatives as plasma kallikrein inhibitors | 20200213 |
WO-2021160718-A1 | Heteroaromatic carboxamide derivatives as plasma kallikrein inhibitors | 20200213 |
WO-2021157684-A1 | Sulfonamide or sulfinamide compound having effect of inducing brd4 protein degradation and pharmaceutical use thereof | 20200206 |
US-2021196710-A1 | Compounds and methods for the targeted degradation of androgen receptor | 20191219 |
WO-2021127443-A1 | Compounds and methods for the targeted degradation of androgen receptor | 20191219 |
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: | -0.2 |
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