1-(2-Chlorophenyl)-3-methyl-2-pyrazolin-5-one - CAS 14580-22-4
Catalog: |
BB010007 |
Product Name: |
1-(2-Chlorophenyl)-3-methyl-2-pyrazolin-5-one |
CAS: |
14580-22-4 |
Synonyms: |
2-(2-chlorophenyl)-5-methyl-4H-pyrazol-3-one |
IUPAC Name: | 2-(2-chlorophenyl)-5-methyl-4H-pyrazol-3-one |
Description: | 1-(2-Chlorophenyl)-3-methyl-2-pyrazolin-5-one (CAS# 14580-22-4) is a useful research chemical compound. |
Molecular Weight: | 208.64 |
Molecular Formula: | C10H9ClN2O |
Canonical SMILES: | CC1=NN(C(=O)C1)C2=CC=CC=C2Cl |
InChI: | InChI=1S/C10H9ClN2O/c1-7-6-10(14)13(12-7)9-5-3-2-4-8(9)11/h2-5H,6H2,1H3 |
InChI Key: | CWESERWNUIUBJU-UHFFFAOYSA-N |
Boiling Point: | 361.6 °C at 760 mmHg |
Density: | 1.32 g/cm3 |
Appearance: | Light yellow crystals |
MDL: | MFCD00043809 |
LogP: | 1.95320 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
JP-2021095568-A | Resin composition and cured film using it | 20191217 |
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Complexity: | 277 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 208.0403406 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 208.0403406 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 32.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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Pyrazoles
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