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159832-34-5 | Benzoic acid, 4-hydroxy-3-(phenylmethoxy)-
CAS No: 159832-34-5 Catalog No: AG001RFJ MDL No:
Product Description
Catalog Number:
AG001RFJ
Chemical Name:
Benzoic acid, 4-hydroxy-3-(phenylmethoxy)-
CAS Number:
159832-34-5
Molecular Formula:
C14H12O4
Molecular Weight:
244.2427
IUPAC Name:
4-hydroxy-3-phenylmethoxybenzoic acid
InChI:
InChI=1S/C14H12O4/c15-12-7-6-11(14(16)17)8-13(12)18-9-10-4-2-1-3-5-10/h1-8,15H,9H2,(H,16,17)
InChI Key:
YEFZIBGGMNFCBS-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(c(c1)OCc1ccccc1)O
Properties
Complexity:
273
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:
2
Isotope Atom Count:
0
Molecular Weight:
244.246g/mol
Monoisotopic Mass:
244.074g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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