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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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

IUPAC name:
tricyclo(3.3.1.1'3,7)decane-1-carboxylic acid

Inventory

EC number:
212-584-6
EC name:
Tricyclo(3.3.1.1'3,7)decane-1-carboxylic acid
CAS number:
828-51-3
CAS number:
828-51-3
Synonyms
Names:
tricyclo(3.3.1.1'3,7)decane-1-carboxylic_acid
Identifier:
IUPAC name
1-Adamantanecarboxylic acid
Identifier:
other: Molecular formula
C11H15O2
Identifier:
other: SMILES notation
C1C2CC3CC1CC(C2)(C3)C(=O)O
Identifier:
other: InChl
InChI=1S/C11H16O2/c12-10(13)11-4-7-1-8(5-11)3-9(2-7)6-11/h7-9H,1-6H2,(H,12,13)
adamantane-1-carboxylic acid

Molecular and structural information

Molecular formula:
C11H16O2
Molecular weight:
180.244
SMILES notation:
OC(=O)C12CC3CC(CC(C3)C1)C2
InChl:
InChI=1/C11H16O2/c12-10(13)11-4-7-1-8(5-11)3-9(2-7)6-11/h7-9H,1-6H2,(H,12,13)
Structural formula:
Chemical structure

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