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3525-22-2 | 4-(4-Methoxyphenoxy);benzoic acid
CAS No: 3525-22-2 Catalog No: AG003K45 MDL No:MFCD02272298
Product Description
Catalog Number:
AG003K45
Chemical Name:
4-(4-Methoxyphenoxy);benzoic acid
CAS Number:
3525-22-2
Molecular Formula:
C14H12O4
Molecular Weight:
244.2427
MDL Number:
MFCD02272298
IUPAC Name:
4-(4-methoxyphenoxy)benzoic acid
InChI:
InChI=1S/C14H12O4/c1-17-11-6-8-13(9-7-11)18-12-4-2-10(3-5-12)14(15)16/h2-9H,1H3,(H,15,16)
InChI Key:
COMKNVCMWUGEPO-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)Oc1ccc(cc1)C(=O)O
Properties
Complexity:
263
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.074g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.246g/mol
Monoisotopic Mass:
244.074g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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