Home Other Building Blocks 1-Methyl-3-propyl-1H-pyrazol-5(4H)-one

1-Methyl-3-propyl-1H-pyrazol-5(4H)-one

CAS No.:
31272-04-5
Catalog Number:
AG003EHQ
Molecular Formula:
C7H12N2O
Molecular Weight:
140.1830
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG003EHQ
Chemical Name:
1-Methyl-3-propyl-1H-pyrazol-5(4H)-one
CAS Number:
31272-04-5
Molecular Formula:
C7H12N2O
Molecular Weight:
140.1830
MDL Number:
MFCD00051849
IUPAC Name:
2-methyl-5-propyl-4H-pyrazol-3-one
InChI:
InChI=1S/C7H12N2O/c1-3-4-6-5-7(10)9(2)8-6/h3-5H2,1-2H3
InChI Key:
RULINAPACRUGOF-UHFFFAOYSA-N
SMILES:
CCCC1=NN(C(=O)C1)C
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.095g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
140.186g/mol
Monoisotopic Mass:
140.095g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties