Home Carboxys ethyl 5-formyl-1-methyl-1H-pyrazole-4-carboxylate

ethyl 5-formyl-1-methyl-1H-pyrazole-4-carboxylate

CAS No.:
40995-41-3
Catalog Number:
AG01AN24
Molecular Formula:
C8H10N2O3
Molecular Weight:
182.1766
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01AN24
Chemical Name:
ethyl 5-formyl-1-methyl-1H-pyrazole-4-carboxylate
CAS Number:
40995-41-3
Molecular Formula:
C8H10N2O3
Molecular Weight:
182.1766
MDL Number:
MFCD24678503
IUPAC Name:
ethyl 5-formyl-1-methylpyrazole-4-carboxylate
InChI:
InChI=1S/C8H10N2O3/c1-3-13-8(12)6-4-9-10(2)7(6)5-11/h4-5H,3H2,1-2H3
InChI Key:
NITOHXVZPBFYTJ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cnn(c1C=O)C
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.069g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.179g/mol
Monoisotopic Mass:
182.069g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
61.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties