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Reference substances

Reference substances

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General information

Inventory

EC number:
201-732-5
EC name:
Phenethyl salicylate
CAS number:
87-22-9

No inventory information available

Reference substance information

IUPAC name:
2-phenylethyl 2-hydroxybenzoate
Synonyms
Names:
Benzoic acid, 2-hydroxy-, 2-phenylethyl ester
Identifier:
IUPAC name
2-phenylethyl salicylate
Identifier:
other: InChl
InChI=1/C15H14O3/c16-14-9-5-4-8-13(14)15(17)18-11-10-12-6-2-1-3-7-12/h1-9,16H,10-11H2
Identifier:
other: SMILES notation
Oc1ccccc1C(=O)OCCc2ccccc2
2-phenylethyl 2-hydroxybenzoate

CAS information

CAS number:
87-22-9

Molecular and structural information

Molecular formula:
C15H14O3
Molecular weight:
242.273
SMILES notation:
c1ccc(cc1)CCOC(=O)c2ccccc2O
InChl:
1S/C15H14O3/c16-14-9-5-4-8-13(14)15(17)18-11-10-12-6-2-1-3-7-12/h1-9,16H,10-11H2
Structural formula:
Chemical structure