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Reference substances

Reference substances

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General information

Inventory

EC number:
226-641-8
EC name:
2-ethylhexyl benzoate
CAS number:
5444-75-7

No inventory information available

Reference substance information

IUPAC name:
2-ethylhexyl benzoate
Synonyms
Names:
1-Hexanol, 2-ethyl-, benzoate
Benzoic acid, 2-ethylhexyl ester

CAS information

CAS number:
5444-75-7

Molecular and structural information

Molecular formula:
C15H22O2
Molecular weight:
234.334
SMILES notation:
CCCCC(CC)COC(=O)c1ccccc1
InChl:
InChI=1/C15H22O2/c1-3-5-9-13(4-2)12-17-15(16)14-10-7-6-8-11-14/h6-8,10-11,13H,3-5,9,12H2,1-2H3
Structural formula:
Chemical structure