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Home Halogens 1-(4-Acetylphenyl)-4-bromo-3,5-dimethylpyrazole

1-(4-Acetylphenyl)-4-bromo-3,5-dimethylpyrazole

CAS No.:
1187385-98-3
Catalog Number:
AG0080XN
Molecular Formula:
C13H13BrN2O
Molecular Weight:
293.1591
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$25
- +
5g
98%
In Stock USA
United States
$75
- +
25g
98%
In Stock USA
United States
$188
- +
100g
98%
In Stock USA
United States
$400
- +
Product Description
Catalog Number:
AG0080XN
Chemical Name:
1-(4-Acetylphenyl)-4-bromo-3,5-dimethylpyrazole
CAS Number:
1187385-98-3
Molecular Formula:
C13H13BrN2O
Molecular Weight:
293.1591
MDL Number:
MFCD12546473
IUPAC Name:
1-[4-(4-bromo-3,5-dimethylpyrazol-1-yl)phenyl]ethanone
InChI:
InChI=1S/C13H13BrN2O/c1-8-13(14)9(2)16(15-8)12-6-4-11(5-7-12)10(3)17/h4-7H,1-3H3
InChI Key:
CZBBKHPUGGSUJX-UHFFFAOYSA-N
SMILES:
CC(=O)c1ccc(cc1)n1nc(c(c1C)Br)C
Properties
Complexity:
289  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.021g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
293.164g/mol
Monoisotopic Mass:
292.021g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties