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1015846-09-9,MFCD09055193
Catalog No.:AA0004T7
1015846-09-9 | 1-[1-(4-Methoxyphenyl)-1h-pyrazol-4-yl]ethanone
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$37.00   $26.00
- +
5g
95%
in stock  
$118.00   $83.00
- +
10g
95%
in stock  
$191.00   $134.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0004T7
Chemical Name:
1-[1-(4-Methoxyphenyl)-1h-pyrazol-4-yl]ethanone
CAS Number:
1015846-09-9
Molecular Formula:
C12H12N2O2
Molecular Weight:
216.2359
MDL Number:
MFCD09055193
IUPAC Name:
1-[1-(4-methoxyphenyl)pyrazol-4-yl]ethanone
InChI:
InChI=1S/C12H12N2O2/c1-9(15)10-7-13-14(8-10)11-3-5-12(16-2)6-4-11/h3-8H,1-2H3
InChI Key:
PGMYSSDXHWIJPK-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)n1ncc(c1)C(=O)C
Properties
Computed Properties
 
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.09g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.24g/mol
Monoisotopic Mass:
216.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

Synonyms
 
1015846-09-9 
1-[1-(4-METHOXYPHENYL)-1H-PYRAZOL-4-YL]ETHANONE 
MCULE-6151427922 
AJ-70878 
Y-5030 
4002420-25G 
4002420-50G 
Ethanone, 1-[1-(4-methoxyphenyl)-1H-pyrazol-4-yl]- 
1-[1-(4-Methoxyphenyl)-1H-pyrazol-4-yl]ethanone AldrichCPR 
1-[1-(4-Methoxyphenyl)-1H-pyrazol-4-yl]ethanone, AldrichCPR 
1-[1-(4-Methoxyphenyl)-1H-pyrazol-4-yl]ethan-1-one 
1-(1-(4-Methoxyphenyl)-1H-pyrazol-4-yl)ethanone 
CTK3J9963 
DTXSID80650789 
ZX-CM002076 
MFCD09055193 
ZINC19087980 
AKOS022184526 
Literature
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