Home Other Building Blocks Methyl 3-acetyl-4-fluorobenzoate

Methyl 3-acetyl-4-fluorobenzoate

CAS No.:
198477-82-6
Catalog Number:
AG00I3NL
Molecular Formula:
C10H9FO3
Molecular Weight:
196.1751
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$94
- +
1g
98%
In Stock USA
United States
$213
- +
5g
98%
In Stock USA
United States
$638
- +
Product Description
Catalog Number:
AG00I3NL
Chemical Name:
Methyl 3-acetyl-4-fluorobenzoate
CAS Number:
198477-82-6
Molecular Formula:
C10H9FO3
Molecular Weight:
196.1751
MDL Number:
MFCD26679549
IUPAC Name:
methyl 3-acetyl-4-fluorobenzoate
InChI:
InChI=1S/C10H9FO3/c1-6(12)8-5-7(10(13)14-2)3-4-9(8)11/h3-5H,1-2H3
InChI Key:
UUACGIJGQLBVJL-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c(c1)C(=O)C)F
Properties
Complexity:
240  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.054g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
196.177g/mol
Monoisotopic Mass:
196.054g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties