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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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:
1,1-dimethyl-2-phenylethyl acetate

Inventory

EC number:
205-781-3
EC name:
α,α-dimethylphenethyl acetate
CAS number:
151-05-3
CAS number:
151-05-3
Synonyms
Names:
Benzeneethanol, .alpha.,.alpha.-dimethyl-, acetate
Benzeneethanol, ?,?-dimethyl-, acetate
Identifier:
IUPAC name
2-methyl-1-phenylpropan-2-yl acetate
Identifier:
other: SMILES notation
CC(=O)OC(C)(C)CC1=CC=CC=C1
1,1-dimethyl-2-phenylethyl acetate

Molecular and structural information

Molecular formula:
C12H16O2
Molecular weight:
192.254
SMILES notation:
CC(=O)OC(C)(C)Cc1ccccc1
InChl:
InChI=1/C12H16O2/c1-10(13)14-12(2,3)9-11-7-5-4-6-8-11/h4-8H,9H2,1-3H3
Structural formula:
Chemical structure

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