Home Aldehydes 1-(2-methylphenyl)-1H-pyrazole-5-carbaldehyde

1-(2-methylphenyl)-1H-pyrazole-5-carbaldehyde

CAS No.:
1159830-71-3
Catalog Number:
AG01BH0F
Molecular Formula:
C11H10N2O
Molecular Weight:
186.2099
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Product Description
Catalog Number:
AG01BH0F
Chemical Name:
1-(2-methylphenyl)-1H-pyrazole-5-carbaldehyde
CAS Number:
1159830-71-3
Molecular Formula:
C11H10N2O
Molecular Weight:
186.2099
MDL Number:
MFCD11975101
IUPAC Name:
2-(2-methylphenyl)pyrazole-3-carbaldehyde
InChI:
InChI=1S/C11H10N2O/c1-9-4-2-3-5-11(9)13-10(8-14)6-7-12-13/h2-8H,1H3
InChI Key:
LCCRZIUVUDSELH-UHFFFAOYSA-N
SMILES:
O=Cc1ccnn1c1ccccc1C
Properties
Complexity:
208  
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:
2.1  
Properties