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Home > Fluorides > 1260849-23-7
1260849-23-7 | Benzoic acid, 2,6-difluoro-4-methoxy-, ethyl ester
CAS No: 1260849-23-7 Catalog No: AG000RFD MDL No:MFCD10566176
Product Description
Catalog Number:
AG000RFD
Chemical Name:
Benzoic acid, 2,6-difluoro-4-methoxy-, ethyl ester
CAS Number:
1260849-23-7
Molecular Formula:
C10H10F2O3
Molecular Weight:
216.1814
MDL Number:
MFCD10566176
IUPAC Name:
ethyl 2,6-difluoro-4-methoxybenzoate
InChI:
InChI=1S/C10H10F2O3/c1-3-15-10(13)9-7(11)4-6(14-2)5-8(9)12/h4-5H,3H2,1-2H3
InChI Key:
PWYVDWXBWUDXKK-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c(F)cc(cc1F)OC
Properties
Complexity:
211
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.06g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.184g/mol
Monoisotopic Mass:
216.06g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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