Home Other Building Blocks methyl 3-(1-ethyl-1H-pyrazol-4-yl)but-2-enoate

methyl 3-(1-ethyl-1H-pyrazol-4-yl)but-2-enoate

CAS No.:
1563994-30-8
Catalog Number:
AG01BDR7
Molecular Formula:
C10H14N2O2
Molecular Weight:
194.2304
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Product Description
Catalog Number:
AG01BDR7
Chemical Name:
methyl 3-(1-ethyl-1H-pyrazol-4-yl)but-2-enoate
CAS Number:
1563994-30-8
Molecular Formula:
C10H14N2O2
Molecular Weight:
194.2304
MDL Number:
MFCD24135078
IUPAC Name:
methyl 3-(1-ethylpyrazol-4-yl)but-2-enoate
InChI:
InChI=1S/C10H14N2O2/c1-4-12-7-9(6-11-12)8(2)5-10(13)14-3/h5-7H,4H2,1-3H3
InChI Key:
CANIVZWVMJIYES-UHFFFAOYSA-N
SMILES:
COC(=O)C=C(c1cnn(c1)CC)C
Properties
Complexity:
238  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.106g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.234g/mol
Monoisotopic Mass:
194.106g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
1.4  
Properties