Home Halogens 1-bromo-4-ethoxy-1,1-difluorobut-3-en-2-one

1-bromo-4-ethoxy-1,1-difluorobut-3-en-2-one

CAS No.:
1186025-41-1
Catalog Number:
AG01BUNT
Molecular Formula:
C6H7BrF2O2
Molecular Weight:
229.0194
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01BUNT
Chemical Name:
1-bromo-4-ethoxy-1,1-difluorobut-3-en-2-one
CAS Number:
1186025-41-1
Molecular Formula:
C6H7BrF2O2
Molecular Weight:
229.0194
IUPAC Name:
1-bromo-4-ethoxy-1,1-difluorobut-3-en-2-one
InChI:
InChI=1S/C6H7BrF2O2/c1-2-11-4-3-5(10)6(7,8)9/h3-4H,2H2,1H3
InChI Key:
IJKFVLQFHXEEEK-UHFFFAOYSA-N
SMILES:
CCOC=CC(=O)C(Br)(F)F
Properties
Complexity:
168  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.96g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.021g/mol
Monoisotopic Mass:
227.96g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.1  
Properties