Home Other Building Blocks 1-(1-methyl-5-phenyl-1H-pyrazol-3-yl)ethan-1-one

1-(1-methyl-5-phenyl-1H-pyrazol-3-yl)ethan-1-one

CAS No.:
1267267-61-7
Catalog Number:
AG01BV8G
Molecular Formula:
C12H12N2O
Molecular Weight:
200.2365
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Product Description
Catalog Number:
AG01BV8G
Chemical Name:
1-(1-methyl-5-phenyl-1H-pyrazol-3-yl)ethan-1-one
CAS Number:
1267267-61-7
Molecular Formula:
C12H12N2O
Molecular Weight:
200.2365
MDL Number:
MFCD19348794
IUPAC Name:
1-(1-methyl-5-phenylpyrazol-3-yl)ethanone
InChI:
InChI=1S/C12H12N2O/c1-9(15)11-8-12(14(2)13-11)10-6-4-3-5-7-10/h3-8H,1-2H3
InChI Key:
UCOFCSJZKKBAQG-UHFFFAOYSA-N
SMILES:
CC(=O)c1cc(n(n1)C)c1ccccc1
Properties
Complexity:
236  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.095g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.241g/mol
Monoisotopic Mass:
200.095g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties