sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks 4,4,4-TRIFLUORO-1-PYRIDIN-3-YLBUTANE-1,3-DIONE

4,4,4-TRIFLUORO-1-PYRIDIN-3-YLBUTANE-1,3-DIONE

CAS No.:
582-73-0
Catalog Number:
AG00EDM9
Molecular Formula:
Molecular Weight:
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
1 week
United States
$73
- +
5g
95%
1 week
United States
$175
- +
25g
95%
1 week
United States
$450
- +
Product Description
Catalog Number:
AG00EDM9
Chemical Name:
4,4,4-TRIFLUORO-1-PYRIDIN-3-YLBUTANE-1,3-DIONE
CAS Number:
582-73-0
MDL Number:
MFCD00041857
IUPAC Name:
4,4,4-trifluoro-1-pyridin-3-ylbutane-1,3-dione
InChI:
InChI=1S/C9H6F3NO2/c10-9(11,12)8(15)4-7(14)6-2-1-3-13-5-6/h1-3,5H,4H2
InChI Key:
MXVYPMBHALRMDU-UHFFFAOYSA-N
NSC Number:
42763
Properties
Complexity:
263  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.035g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.147g/mol
Monoisotopic Mass:
217.035g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
47A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Literature
Title Journal
4,7-Dichloro benzothien-2-yl sulfonylaminomethyl boronic acid: first boronic acid-derived beta-lactamase inhibitor with class A, C, and D activity. Bioorganic & medicinal chemistry letters 20100415
Properties