Home Aldehydes 1015845-56-3
1015845-56-3,MFCD08059860
Catalog No.:AA0004RH
1015845-56-3 | Benzaldehyde, 5-methoxy-2-(1H-pyrazol-1-yl)-
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Technical Information
Catalog Number:
AA0004RH
Chemical Name:
Benzaldehyde, 5-methoxy-2-(1H-pyrazol-1-yl)-
CAS Number:
1015845-56-3
Molecular Formula:
C11H10N2O2
Molecular Weight:
202.2093
MDL Number:
MFCD08059860
IUPAC Name:
5-methoxy-2-pyrazol-1-ylbenzaldehyde
InChI:
InChI=1S/C11H10N2O2/c1-15-10-3-4-11(9(7-10)8-14)13-6-2-5-12-13/h2-8H,1H3
InChI Key:
WBOASTROTLWICF-UHFFFAOYSA-N
SMILES:
O=Cc1cc(OC)ccc1n1cccn1
Properties
Computed Properties
 
Complexity:
223  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.074g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.213g/mol
Monoisotopic Mass:
202.074g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

Synonyms
 
5-Methoxy-2-(1H-pyrazol-1-yl)benzaldehyde 
1015845-56-3 
AKOS006339508 
5-methoxy-2-(pyrazol-1-yl)benzaldehyde 
AJ-71200 
DA-18727 
TR-000398 
FT-0681584 
Y-3432 
Benzaldehyde, 5-methoxy-2-(1H-pyrazol-1-yl)- 
I01-14569 
4011977-25G 
SCHEMBL415805 
4011977-50G 
5-Methoxy-2-(1H-pyrazol-1-yl)benzaldehyde, AldrichCPR 
C11H10N2O2 
CTK3J9925 
DTXSID30650850 
WBOASTROTLWICF-UHFFFAOYSA-N 
ZX-CM003823 
7378AC 
MFCD08059860 
ZINC19089516 
Literature
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