Home Aldehydes Benzaldehyde, 4-(1-methyl-1H-pyrazol-5-yl)-

Benzaldehyde, 4-(1-methyl-1H-pyrazol-5-yl)-

CAS No.:
179055-28-8
Catalog Number:
AG0026R4
Molecular Formula:
C11H10N2O
Molecular Weight:
186.2099
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Product Description
Catalog Number:
AG0026R4
Chemical Name:
Benzaldehyde, 4-(1-methyl-1H-pyrazol-5-yl)-
CAS Number:
179055-28-8
Molecular Formula:
C11H10N2O
Molecular Weight:
186.2099
MDL Number:
MFCD08669907
IUPAC Name:
4-(2-methylpyrazol-3-yl)benzaldehyde
InChI:
InChI=1S/C11H10N2O/c1-13-11(6-7-12-13)10-4-2-9(8-14)3-5-10/h2-8H,1H3
InChI Key:
NDNVJHWXCUOBSL-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)c1ccnn1C
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:
1.4  
Properties