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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.

The new ECHA CHEM database has been released by ECHA, and it now contains all REACH registration data. There are more details on the transition of ECHA's published data to ECHA CHEM here.

Diss Factsheets

Reference substances

Reference substances

Currently viewing:
IUPAC name:
hexyl butanoate

Inventory

EC number:
220-136-6
EC name:
Hexyl butyrate
CAS number:
2639-63-6
CAS number:
2639-63-6
Synonyms
Names:
Identifier:
IUPAC name
hexyl butanoate
Identifier:
IUPAC name
hexyl butyrate
Identifier:
other: InChl
InChI=1/C10H20O2/c1-3-5-6-7-9-12-10(11)8-4-2/h3-9H2,1-2H3
Identifier:
other: SMILES notation
O=C(OCCCCCC)CCC

Molecular and structural information

Molecular formula:
C10H20O2
Molecular weight:
172.265
SMILES notation:
CCCCCCOC(=O)CCC
InChl:
InChI=1S/C10H20O2/c1-3-5-6-7-9-12-10(11)8-4-2/h3-9H2,1-2H3
Structural formula:
Chemical structure

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