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1365272-32-7 | [1,1'-Biphenyl]-4-carboxylic acid, 3,5'-difluoro-2'-methoxy-, methyl ester
CAS No: 1365272-32-7 Catalog No: AG00120J MDL No:MFCD21609601
Product Description
Catalog Number:
AG00120J
Chemical Name:
[1,1'-Biphenyl]-4-carboxylic acid, 3,5'-difluoro-2'-methoxy-, methyl ester
CAS Number:
1365272-32-7
Molecular Formula:
C15H12F2O3
Molecular Weight:
278.2508
MDL Number:
MFCD21609601
IUPAC Name:
methyl 2-fluoro-4-(5-fluoro-2-methoxyphenyl)benzoate
InChI:
InChI=1S/C15H12F2O3/c1-19-14-6-4-10(16)8-12(14)9-3-5-11(13(17)7-9)15(18)20-2/h3-8H,1-2H3
InChI Key:
IKPFZGSKLLCAEN-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(cc1F)c1cc(F)ccc1OC
Properties
Complexity:
337
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.075g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
278.255g/mol
Monoisotopic Mass:
278.075g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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