4551-69-3
Product Name:
4-BENZOYL-3-METHYL-1-PHENYL-5-PYRAZOLINONE
Formula:
C17H14N2O2
Synonyms:
1-Phenyl-3-methyl-4-benzoyl-2-pyrazolin-5-one;HPMBP
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Yellow crystalline powder; [Alfa Aesar MSDS] |
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Chemical Classes | Nitrogen Compounds -> Pyrazoles |
COMPUTED DESCRIPTORS
Molecular Weight | 278.30 g/mol |
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XLogP3 | 2.9 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 3 |
Exact Mass | 278.105527694 g/mol |
Monoisotopic Mass | 278.105527694 g/mol |
Topological Polar Surface Area | 49.7 Ų |
Heavy Atom Count | 21 |
Formal Charge | 0 |
Complexity | 446 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |