Home Aldehydes 1-propyl-1H-pyrazole-5-carbaldehyde

1-propyl-1H-pyrazole-5-carbaldehyde

CAS No.:
1006458-89-4
Catalog Number:
AG00JEQF
Molecular Formula:
C7H10N2O
Molecular Weight:
138.1671
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Product Description
Catalog Number:
AG00JEQF
Chemical Name:
1-propyl-1H-pyrazole-5-carbaldehyde
CAS Number:
1006458-89-4
Molecular Formula:
C7H10N2O
Molecular Weight:
138.1671
MDL Number:
MFCD04970273
IUPAC Name:
2-propylpyrazole-3-carbaldehyde
InChI:
InChI=1S/C7H10N2O/c1-2-5-9-7(6-10)3-4-8-9/h3-4,6H,2,5H2,1H3
InChI Key:
RADYDRNLVYMXFZ-UHFFFAOYSA-N
SMILES:
CCCn1nccc1C=O
Properties
Complexity:
116  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.079g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
138.17g/mol
Monoisotopic Mass:
138.079g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties