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1697460-73-3

1697460-73-3 | 5-(1-methyl-1H-pyrazol-5-yl)furan-2-carbaldehyde

CAS No: 1697460-73-3 Catalog No: AG01CA23 MDL No:

Product Description

Catalog Number:
AG01CA23
Chemical Name:
5-(1-methyl-1H-pyrazol-5-yl)furan-2-carbaldehyde
CAS Number:
1697460-73-3
Molecular Formula:
C9H8N2O2
Molecular Weight:
176.1720
IUPAC Name:
5-(2-methylpyrazol-3-yl)furan-2-carbaldehyde
InChI:
InChI=1S/C9H8N2O2/c1-11-8(4-5-10-11)9-3-2-7(6-12)13-9/h2-6H,1H3
InChI Key:
NZNHSFZHFBBGTD-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(o1)c1ccnn1C

Properties

Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.059g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.175g/mol
Monoisotopic Mass:
176.059g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
48A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  

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