Home Aldehydes 1015845-89-2
1015845-89-2,MFCD08059904
Catalog No.:AA0004S9
1015845-89-2 | 2-Methyl-4-(1h-pyrazol-1-yl)benzaldehyde
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1g
95%
in stock  
$37.00   $26.00
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5g
95%
in stock  
$107.00   $75.00
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Technical Information
Catalog Number:
AA0004S9
Chemical Name:
2-Methyl-4-(1h-pyrazol-1-yl)benzaldehyde
CAS Number:
1015845-89-2
Molecular Formula:
C11H10N2O
Molecular Weight:
186.2099
MDL Number:
MFCD08059904
IUPAC Name:
2-methyl-4-pyrazol-1-ylbenzaldehyde
InChI:
InChI=1S/C11H10N2O/c1-9-7-11(4-3-10(9)8-14)13-6-2-5-12-13/h2-8H,1H3
InChI Key:
KDHRBBGULNYWMM-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1C)n1cccn1
Properties
Computed 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:
1.7  

Synonyms
 
2-Methyl-4-(1H-pyrazol-1-yl)benzaldehyde 
1015845-89-2 
AKOS005173467 
MCULE-1646889647 
2-methyl-4-(pyrazol-1-yl)benzaldehyde 
AJ-71291 
AS-47365 
BP-11039 
DA-18651 
AB0157539 
FT-0683397 
K-0240 
benzaldehyde, 2-methyl-4-(1H-pyrazol-1-yl)- 
I01-13668 
2-Methyl-4-(1H-pyrazol-1-yl)benzaldehyde, AldrichCPR 
C11H10N2O 
CTK3J9947 
DTXSID20650869 
ALBB-011888 
2-methyl-4-pyrazol-1-ylbenzaldehyde 
7390AC 
MFCD08059904 
ZINC19089878 
Literature
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