Home Aldehydes 3,5-diethyl-1-methyl-1H-pyrazole-4-carbaldehyde

3,5-diethyl-1-methyl-1H-pyrazole-4-carbaldehyde

CAS No.:
1353498-48-2
Catalog Number:
AG01A2KI
Molecular Formula:
C9H14N2O
Molecular Weight:
166.2203
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Product Description
Catalog Number:
AG01A2KI
Chemical Name:
3,5-diethyl-1-methyl-1H-pyrazole-4-carbaldehyde
CAS Number:
1353498-48-2
Molecular Formula:
C9H14N2O
Molecular Weight:
166.2203
MDL Number:
MFCD21090697
IUPAC Name:
3,5-diethyl-1-methylpyrazole-4-carbaldehyde
InChI:
InChI=1S/C9H14N2O/c1-4-8-7(6-12)9(5-2)11(3)10-8/h6H,4-5H2,1-3H3
InChI Key:
AESWCQFHUDAVDG-UHFFFAOYSA-N
SMILES:
CCc1nn(c(c1C=O)CC)C
Properties
Complexity:
161  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.111g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.224g/mol
Monoisotopic Mass:
166.111g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties