Home Aldehydes 4-(3-methyl-1H-pyrazol-1-yl)benzaldehyde

4-(3-methyl-1H-pyrazol-1-yl)benzaldehyde

CAS No.:
79382-71-1
Catalog Number:
AG01E19Q
Molecular Formula:
C11H10N2O
Molecular Weight:
186.2099
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Product Description
Catalog Number:
AG01E19Q
Chemical Name:
4-(3-methyl-1H-pyrazol-1-yl)benzaldehyde
CAS Number:
79382-71-1
Molecular Formula:
C11H10N2O
Molecular Weight:
186.2099
MDL Number:
MFCD16770012
IUPAC Name:
4-(3-methylpyrazol-1-yl)benzaldehyde
InChI:
InChI=1S/C11H10N2O/c1-9-6-7-13(12-9)11-4-2-10(8-14)3-5-11/h2-8H,1H3
InChI Key:
ILCHHKXIMMFZNI-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)n1ccc(n1)C
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.079g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.214g/mol
Monoisotopic Mass:
186.079g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties