Home Carboxys Methyl 1-phenyl-1h-pyrazole-4-carboxylate

Methyl 1-phenyl-1h-pyrazole-4-carboxylate

CAS No.:
7188-96-7
Catalog Number:
AG0061GV
Molecular Formula:
C11H10N2O2
Molecular Weight:
202.2093
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Product Description
Catalog Number:
AG0061GV
Chemical Name:
Methyl 1-phenyl-1h-pyrazole-4-carboxylate
CAS Number:
7188-96-7
Molecular Formula:
C11H10N2O2
Molecular Weight:
202.2093
MDL Number:
MFCD05739143
IUPAC Name:
methyl 1-phenylpyrazole-4-carboxylate
InChI:
InChI=1S/C11H10N2O2/c1-15-11(14)9-7-12-13(8-9)10-5-3-2-4-6-10/h2-8H,1H3
InChI Key:
KWBAYDFXUVGRPW-UHFFFAOYSA-N
SMILES:
COC(=O)c1cnn(c1)c1ccccc1
Properties
Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.074g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
202.213g/mol
Monoisotopic Mass:
202.074g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties