(4-Methylphenyl)-1-(2H)-phthalazinone - CAS 51334-85-1
Catalog: |
BB027411 |
Product Name: |
(4-Methylphenyl)-1-(2H)-phthalazinone |
CAS: |
51334-85-1 |
Synonyms: |
4-(4-methylphenyl)-2H-phthalazin-1-one |
IUPAC Name: | 4-(4-methylphenyl)-2H-phthalazin-1-one |
Description: | (4-Methylphenyl)-1-(2H)-phthalazinone (CAS# 51334-85-1) is a useful research chemical. |
Molecular Weight: | 236.27 |
Molecular Formula: | C15H12N2O |
Canonical SMILES: | CC1=CC=C(C=C1)C2=NNC(=O)C3=CC=CC=C32 |
InChI: | InChI=1S/C15H12N2O/c1-10-6-8-11(9-7-10)14-12-4-2-3-5-13(12)15(18)17-16-14/h2-9H,1H3,(H,17,18) |
InChI Key: | QBGWUKDMIGJTDU-UHFFFAOYSA-N |
MDL: | MFCD00222976 |
LogP: | 2.89850 |
GHS Hazard Statement: | H315 (97.5%): 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 |
EP-3252049-A1 | Phthalazinones and isoquinolinones as rock inhibitors | 20130118 |
EP-3252050-A1 | Phthalazinones and isoquinolinones as rock inhibitors | 20130118 |
EP-2562294-A2 | Plating bath and method | 20110822 |
JP-2013049922-A | Plating bath and method | 20110822 |
JP-6186118-B2 | Plating bath and method | 20110822 |
PMID | Publication Date | Title | Journal |
16545955 | 20060515 | New 4-(4-methyl-phenyl)phthalazin-1(2H)-one derivatives and their effects on alpha1-receptors | Bioorganic & medicinal chemistry letters |
Complexity: | 356 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 236.094963011 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 236.094963011 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 41.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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