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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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

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Inventory

CAS number:
135800-37-2

Synonyms

Molecular and structural information

Molecular formula:
C16H32O2 to C26H52O2
Molecular weight:
256.4 - 396.7
SMILES notation:
Example for SMILES code:
O=C(OCC(CCCC)CC)CCCCCCC
and
O=C(OCC(CCCC)CC)CCCCCCCCCCCCCCCCC
InChl:
Example for InChI:
InChI=1/C16H32O2/c1-4-7-9-10-11-13-16(17)18-14-15(6-3)12-8-5-2/h15H,4-14H2,1-3H3
and
InChI=1/C26H50O2/c1-4-7-9-10-11-12-13-14-15-16-17-18-19-20-21-23-26(27)28-24-25(6-3)22-8-5-2/h14-15,25H,4-13,16-24H2,1-3H3/b15-14+
Structural formula:
Chemical structure

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