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2,6-Dibromo-3,3,5,5-tetramethylcyclohexan-1-one

HCID 102743
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Basic information

CAS
2065-76-1
Standard SMILES
CC1(C)CC(C)(C)C(Br)C(=O)C1Br
InChIKey
IZQKDIHFMIWQCL-UHFFFAOYSA-N
Molecular formula
C10H16Br2O
Average molar mass
312.04 g/mol
Monoisotopic mass
309.95679

Names & identifiers

Preferred name
2,6-Dibromo-3,3,5,5-tetramethylcyclohexan-1-one
IUPAC
2,6-dibromo-3,3,5,5-tetramethylcyclohexan-1-one
English name
2,6-dibromo-3,3,5,5-tetramethylcyclohexan-1-one
Molecular formula
C10H16Br2O
Molecular weight
312.04144

Names & synonyms

2,6-Dibromo-3,3,5,5-tetramethylcyclohexan-1-one2065-76-12,6-dibromo-3,3,5,5-tetramethylcyclohexanoneEINECS 218-182-7SCHEMBL11040007DTXSID20942852NS000465642,6-dibromo-3,3,5,5-tetramethyl-cyclohexanoneCyclohexanone, 2,6-dibromo-3,3,5,5-tetramethyl-

Database identifiers

CAS
2065-76-1
PubChem CID
102743
DTXSID
DTXSID20942852
EC Number
218-182-7
Nikkaji
J298.680I

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
17.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
13
Formal charge
0
Complexity
211

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Related reactions

1 records
New reaction record
HRID 1758013 reaction equation
HRID 1758013As reactantuspto-grants-1983_02

Compound notes

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