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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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:
C6-C7 isoalkanes

Inventory

Synonyms

Molecular and structural information

Molecular formula:
C6H14 and C7H16
Molecular weight:
>= 86.2 - <= 100.2
SMILES notation:
CCC(C)(C)C
CC(C)C(C)C
CC(C)CCC
CCC(C)CC
CCC(CC)CC
CC(C)(C)C(C)C
CC(C)(C)CCC
CC(C)CC(C)C
CCC(C)(C)CC
CC(C)C(C)CC
CCC(C)CCC
CC(C)CCCC
InChl:
InChI=1S/C6H14/c1-5-6(2,3)4/h5H2,1-4H3
InChI=1S/C6H14/c1-5(2)6(3)4/h5-6H,1-4H3
InChI=1S/C6H14/c1-4-5-6(2)3/h6H,4-5H2,1-3H3
InChI=1S/C6H14/c1-4-6(3)5-2/h6H,4-5H2,1-3H3
InChI=1S/C7H16/c1-4-7(5-2)6-3/h7H,4-6H2,1-3H3
InChI=1S/C7H16/c1-6(2)7(3,4)5/h6H,1-5H3
InChI=1S/C7H16/c1-5-6-7(2,3)4/h5-6H2,1-4H3
InChI=1S/C7H16/c1-6(2)5-7(3)4/h6-7H,5H2,1-4H3
InChI=1S/C7H16/c1-5-7(3,4)6-2/h5-6H2,1-4H3
InChI=1S/C7H16/c1-5-7(4)6(2)3/h6-7H,5H2,1-4H3
InChI=1S/C7H16/c1-4-6-7(3)5-2/h7H,4-6H2,1-3H3
InChI=1S/C7H16/c1-4-5-6-7(2)3/h7H,4-6H2,1-3H3
Structural formula:
Chemical structure

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