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Home Sulfos 4-(4-Bromo-1H-pyrazol-1-yl)-N,N-diethylbenzenesulfonamide

4-(4-Bromo-1H-pyrazol-1-yl)-N,N-diethylbenzenesulfonamide

CAS No.:
1199773-40-4
Catalog Number:
AG000PYG
Molecular Formula:
C13H16BrN3O2S
Molecular Weight:
358.2540
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$225
- +
25g
98%
In Stock USA
United States
$850
- +
Product Description
Catalog Number:
AG000PYG
Chemical Name:
4-(4-Bromo-1H-pyrazol-1-yl)-N,N-diethylbenzenesulfonamide
CAS Number:
1199773-40-4
Molecular Formula:
C13H16BrN3O2S
Molecular Weight:
358.2540
MDL Number:
MFCD13195727
IUPAC Name:
4-(4-bromopyrazol-1-yl)-N,N-diethylbenzenesulfonamide
InChI:
InChI=1S/C13H16BrN3O2S/c1-3-16(4-2)20(18,19)13-7-5-12(6-8-13)17-10-11(14)9-15-17/h5-10H,3-4H2,1-2H3
InChI Key:
MXLGFYKOTIFKLQ-UHFFFAOYSA-N
SMILES:
CCN(S(=O)(=O)c1ccc(cc1)n1ncc(c1)Br)CC
Properties
Complexity:
400  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
357.015g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
358.254g/mol
Monoisotopic Mass:
357.015g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties