Home Other Building Blocks 1-Chloro-3,3,3-trifluoroacetone

1-Chloro-3,3,3-trifluoroacetone

CAS No.:
431-37-8
Catalog Number:
AG00D9X5
Molecular Formula:
C3H2ClF3O
Molecular Weight:
146.4956
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
96%
In Stock USA
United States
$119
- +
10g
96%
In Stock USA
United States
$200
- +
25g
96%
In Stock USA
United States
$369
- +
100g
96%
In Stock USA
United States
$1113
- +
Product Description
Catalog Number:
AG00D9X5
Chemical Name:
1-Chloro-3,3,3-trifluoroacetone
CAS Number:
431-37-8
Molecular Formula:
C3H2ClF3O
Molecular Weight:
146.4956
MDL Number:
MFCD01631508
IUPAC Name:
3-chloro-1,1,1-trifluoropropan-2-one
InChI:
InChI=1S/C3H2ClF3O/c4-1-2(8)3(5,6)7/h1H2
InChI Key:
OONJVQFMOZAXOI-UHFFFAOYSA-N
SMILES:
ClCC(=O)C(F)(F)F
Properties
Complexity:
97.2  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.975g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
146.493g/mol
Monoisotopic Mass:
145.975g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties