Phenyl salicylate

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CAS Number

118-55-8

Chemical Information

Phenyl Salicylate

Phenyl salicylate is a benzoate ester that is the phenyl ester of salicylic acid. Also known as salol, it can be formed by heating salicylic acid with phenol and is used in the manufacture of some polymers, lacquers, adhesives, waxes and polishes. It has a role as an ultraviolet filter. It is a member of salicylates, a member of phenols and a benzoate ester. It is functionally related to a salicylic acid.

CAS Number	118-55-8
PubChem CID	8361
IUPAC Name	phenyl 2-hydroxybenzoate
Molecular Formula	C13H10O3
Molecular Weight	214.22
XLogP	3.8
Topological Polar Surface Area	46.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Heavy Atom Count	16
Formal Charge	0
Complexity	233

SMILES

C1=CC=C(C=C1)OC(=O)C2=CC=CC=C2O

InChI

InChI=1S/C13H10O3/c14-12-9-5-4-8-11(12)13(15)16-10-6-2-1-3-7-10/h1-9,14H

InChIKey

ZQBAKBUEJOMQEX-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 118-55-8

CID: 8361

Formula: C13H10O3

MW: 214.22

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	214.22
XLogP3	3.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	214.062994177
Monoisotopic Mass	214.062994177
Topological Polar Surface Area	46.5 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	233
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Catalog	Name
462426-01	Phenyl Salicylate
HY-B1731R-01	Phenyl salicylate (Standard)
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188765	Phenyl Ethyl Salicylate for Synthesis 97.0%
MBS340874-01	Salicylate
FI67035-01	Isopropyl salicylate
FN26205-01	Nicotine salicylate
HY-B0250A	Lamivudine (salicylate)
HY-Y1074-01	Ethyl salicylate

Phenyl salicylate

Chemical Information

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