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164161-33-5 | Benzoic acid, 5-(benzoyloxy)-2-hydroxy-
CAS No: 164161-33-5 Catalog No: AG001UOX MDL No:
Product Description
Catalog Number:
AG001UOX
Chemical Name:
Benzoic acid, 5-(benzoyloxy)-2-hydroxy-
CAS Number:
164161-33-5
Molecular Formula:
C14H10O5
Molecular Weight:
258.2262
IUPAC Name:
5-benzoyloxy-2-hydroxybenzoic acid
InChI:
InChI=1S/C14H10O5/c15-12-7-6-10(8-11(12)13(16)17)19-14(18)9-4-2-1-3-5-9/h1-8,15H,(H,16,17)
InChI Key:
YOOBUVCIXDPIED-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)Oc1ccc(c(c1)C(=O)O)O
Properties
Complexity:
335
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.053g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
258.229g/mol
Monoisotopic Mass:
258.053g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
83.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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