Home Other Building Blocks 3,3-dimethyl-2-oxobutyl 2-fluorobenzoate

3,3-dimethyl-2-oxobutyl 2-fluorobenzoate

CAS No.:
474945-57-8
Catalog Number:
AG019KM0
Molecular Formula:
C13H15FO3
Molecular Weight:
238.2548
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Product Description
Catalog Number:
AG019KM0
Chemical Name:
3,3-dimethyl-2-oxobutyl 2-fluorobenzoate
CAS Number:
474945-57-8
Molecular Formula:
C13H15FO3
Molecular Weight:
238.2548
MDL Number:
MFCD09802048
IUPAC Name:
(3,3-dimethyl-2-oxobutyl) 2-fluorobenzoate
InChI:
InChI=1S/C13H15FO3/c1-13(2,3)11(15)8-17-12(16)9-6-4-5-7-10(9)14/h4-7H,8H2,1-3H3
InChI Key:
UJYJQOOOUWLZPW-UHFFFAOYSA-N
SMILES:
O=C(C(C)(C)C)COC(=O)c1ccccc1F
Properties
Complexity:
294  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.101g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.258g/mol
Monoisotopic Mass:
238.101g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties