CAS
950778-43-5 Purity
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950778-43-5 Purity
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1H-Pyrazole-4-carboxaldehyde,2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-
CAS
950-81-2
Catalog Number
ACM950812
Category
Other Products
Molecular Weight
216.24
Molecular Formula
C12H12N2O2
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Specification
Synonyms
Antipyraldehyde, Febranine, Antipyrinaldehyd, 4-Formylantipyrine, 4-Antipyrinecarboxaldehyde, Antipyrine, 4-formyl-, MLS000720037, 123250_ALDRICH, NSC60408, EINECS 213-452-0, SBB000559, ZINC00119347, SMR000304566, 2,3-Dimethyl-5-oxo-1-phenyl-3-pyrazoline-4-carboxaldehyde, 1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazole-4-carbaldehyde, 1H-Pyrazole-4-carboxaldehyde, 2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-, 2,3-Dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazole-4-carbaldehyde, 950-81-2
IUPAC Name
1,5-dimethyl-3-oxo-2-phenylpyrazole-4-carbaldehyde
InChI Key
QFYZFYDOEJZMDX-UHFFFAOYSA-N
Boiling Point
334.8ºC at 760mmHg
Melting Point
162-165ºC(lit.)
Flash Point
145.4ºC
Density
1.292g/cm³
Exact Mass
216.09000
Hazard Statements
Xi: Irritant;
H-Bond Acceptor
3
H-Bond Donor
0
Safety Description
26-36
WGK Germany
3
What is the molecular formula of 4-Formyl-antipyrine?
The molecular formula of 4-Formyl-antipyrine is C12H12N2O2.
What is the molecular weight of 4-Formyl-antipyrine?
The molecular weight of 4-Formyl-antipyrine is 216.24 g/mol.
What are the synonyms for 4-Formyl-antipyrine?
Some synonyms for 4-Formyl-antipyrine include 1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazole-4-carbaldehyde and Antipyraldehyde.
What is the InChIKey for 4-Formyl-antipyrine?
The InChIKey for 4-Formyl-antipyrine is QFYZFYDOEJZMDX-UHFFFAOYSA-N.
What is the Canonical SMILES representation of 4-Formyl-antipyrine?
The Canonical SMILES representation of 4-Formyl-antipyrine is CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C=O.
What is the CAS number for 4-Formyl-antipyrine?
The CAS number for 4-Formyl-antipyrine is 950-81-2.
How many rotatable bonds does 4-Formyl-antipyrine have?
4-Formyl-antipyrine has 2 rotatable bonds.
What is the topological polar surface area of 4-Formyl-antipyrine?
The topological polar surface area of 4-Formyl-antipyrine is 40.6 Ų.
How many hydrogen bond acceptors does 4-Formyl-antipyrine have?
4-Formyl-antipyrine has 3 hydrogen bond acceptors.
What is the Covalently-Bonded Unit Count of 4-Formyl-antipyrine?
The Covalently-Bonded Unit Count of 4-Formyl-antipyrine is 1.
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