Home Other Building Blocks 3-(1-methyl-1H-pyrazol-4-yl)propanal

3-(1-methyl-1H-pyrazol-4-yl)propanal

CAS No.:
192661-39-5
Catalog Number:
AG01C21C
Molecular Formula:
C7H10N2O
Molecular Weight:
138.1671
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Product Description
Catalog Number:
AG01C21C
Chemical Name:
3-(1-methyl-1H-pyrazol-4-yl)propanal
CAS Number:
192661-39-5
Molecular Formula:
C7H10N2O
Molecular Weight:
138.1671
MDL Number:
MFCD16824625
IUPAC Name:
3-(1-methylpyrazol-4-yl)propanal
InChI:
InChI=1S/C7H10N2O/c1-9-6-7(5-8-9)3-2-4-10/h4-6H,2-3H2,1H3
InChI Key:
SMHZEDATPGQPHV-UHFFFAOYSA-N
SMILES:
O=CCCc1cnn(c1)C
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:
-0.1  
Properties