6-Methyl-3(2H)-pyridazinone - CAS 13327-27-0
Catalog: |
BB007721 |
Product Name: |
6-Methyl-3(2H)-pyridazinone |
CAS: |
13327-27-0 |
Synonyms: |
3-methyl-1H-pyridazin-6-one; 3-methyl-1H-pyridazin-6-one |
IUPAC Name: | 3-methyl-1H-pyridazin-6-one |
Description: | 6-Methyl-3(2H)-pyridazinone (CAS# 13327-27-0) is a lignin-based dye used on wool. 6-Methyl-3-pyridazinone is also used as a reactant for the synthesis of C-(1-aryl-cyclohexyl)-methylamine derivatives as selective, orally available inhibitors of dipeptidyl peptidase IV, imidazopyridazinone derivatives as PDE7 inhibitors and pyridazinone derivatives with an arylpiperazinylalkyl chain as a potentent, orally active, antinociceptive agent. |
Molecular Weight: | 110.11 |
Molecular Formula: | C5H6N2O |
Canonical SMILES: | CC1=NNC(=O)C=C1 |
InChI: | InChI=1S/C5H6N2O/c1-4-2-3-5(8)7-6-4/h2-3H,1H3,(H,7,8) |
InChI Key: | QZWIXLPWMGHDDD-UHFFFAOYSA-N |
Boiling Point: | 310.3 ℃ at 760 mmHg |
Density: | 1.22 g/cm3 |
Storage: | Sealed in dry, Room Temperature |
MDL: | MFCD00039720 |
LogP: | 0.07830 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-111116572-A | Oxadiazole derivatives, their preparation and use | 20181031 |
US-2021171475-A1 | Compounds | 20180831 |
WO-2019208614-A1 | Resin composition, laminate, resin composition layer-attached semiconductor wafer, substrate for mounting resin composition layer-attached semiconductor, and semiconductor device | 20180426 |
EP-3786200-A1 | Resin composition, laminate, resin composition layer-attached semiconductor wafer, substrate for mounting resin composition layer-attached semiconductor, and semiconductor device | 20180426 |
KR-20210004971-A | Resin composition, laminate, semiconductor wafer with resin composition layer, semiconductor mounting substrate with resin composition layer, and semiconductor device | 20180426 |
Complexity: | 169 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 110.048012819 |
Formal Charge: | 0 |
Heavy Atom Count: | 8 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 110.048012819 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 41.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.4 |
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