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Home > Fluorides > 864684-84-4
864684-84-4 | Benzoic acid,3-(fluoromethoxy)-4,5-dimethoxy-, methyl ester
CAS No: 864684-84-4 Catalog No: AG004WIC MDL No:
Product Description
Catalog Number:
AG004WIC
Chemical Name:
Benzoic acid,3-(fluoromethoxy)-4,5-dimethoxy-, methyl ester
CAS Number:
864684-84-4
Molecular Formula:
C11H13FO5
Molecular Weight:
244.2163
IUPAC Name:
methyl 3-(fluoromethoxy)-4,5-dimethoxybenzoate
InChI:
InChI=1S/C11H13FO5/c1-14-8-4-7(11(13)16-3)5-9(17-6-12)10(8)15-2/h4-5H,6H2,1-3H3
InChI Key:
DZDGTVZPPVOEAO-UHFFFAOYSA-N
SMILES:
FCOc1cc(cc(c1OC)OC)C(=O)OC
Properties
Complexity:
248
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.075g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.218g/mol
Monoisotopic Mass:
244.075g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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