Home Other Building Blocks methyl 2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)acetate

methyl 2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)acetate

CAS No.:
1007502-22-8
Catalog Number:
AG01AL9O
Molecular Formula:
C10H16N2O2
Molecular Weight:
196.2462
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Product Description
Catalog Number:
AG01AL9O
Chemical Name:
methyl 2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)acetate
CAS Number:
1007502-22-8
Molecular Formula:
C10H16N2O2
Molecular Weight:
196.2462
MDL Number:
MFCD08700818
IUPAC Name:
methyl 2-(1-ethyl-3,5-dimethylpyrazol-4-yl)acetate
InChI:
InChI=1S/C10H16N2O2/c1-5-12-8(3)9(7(2)11-12)6-10(13)14-4/h5-6H2,1-4H3
InChI Key:
IDKCAZDMSUSXAQ-UHFFFAOYSA-N
SMILES:
COC(=O)Cc1c(C)nn(c1C)CC
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.121g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.25g/mol
Monoisotopic Mass:
196.121g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties