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

ethyl 3-(1-methyl-1H-pyrazol-4-yl)butanoate

CAS No.:
1909347-90-5
Catalog Number:
AG01C3JA
Molecular Formula:
C10H16N2O2
Molecular Weight:
196.2462
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Product Description
Catalog Number:
AG01C3JA
Chemical Name:
ethyl 3-(1-methyl-1H-pyrazol-4-yl)butanoate
CAS Number:
1909347-90-5
Molecular Formula:
C10H16N2O2
Molecular Weight:
196.2462
MDL Number:
MFCD29060486
IUPAC Name:
ethyl 3-(1-methylpyrazol-4-yl)butanoate
InChI:
InChI=1S/C10H16N2O2/c1-4-14-10(13)5-8(2)9-6-11-12(3)7-9/h6-8H,4-5H2,1-3H3
InChI Key:
WDSWGSPABXRSAM-UHFFFAOYSA-N
SMILES:
CCOC(=O)CC(c1cnn(c1)C)C
Properties
Complexity:
197  
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:
5  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties