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Di-tert-butyl 2,4,4-trimethyldiperoxyadipate

HCID 3034331
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Basic information

CAS
21850-40-8
Standard SMILES
CC(CC(C)(C)CC(=O)OOC(C)(C)C)C(=O)OOC(C)(C)C
InChIKey
BXBGCAYZSCEGBY-UHFFFAOYSA-N
Molecular formula
C17H32O6
Average molar mass
332.4 g/mol
Monoisotopic mass
332.21988874

Names & identifiers

Preferred name
Di-tert-butyl 2,4,4-trimethyldiperoxyadipate
IUPAC
ditert-butyl 2,4,4-trimethylhexanediperoxoate
English name
di-tert-butyl 2,4,4-trimethyldiperoxyadipate
Molecular formula
C17H32O6
Molecular weight
332.43

Names & synonyms

21850-40-8Di-tert-butyl 2,4,4-trimethyldiperoxyadipateEINECS 244-615-4DTXSID80944458BXBGCAYZSCEGBY-UHFFFAOYSA-NNS00050026Di-tert-butyl 2,4,4-trimethylhexanediperoxoate2,4,4-Trimethylhexanediperoxoic acid bis(1,1-dimethylethyl) esterHexanediperoxoic acid, 2,4,4-trimethyl-, 1,6-bis(1,1-dimethylethyl) ester

Database identifiers

CAS
21850-40-8
PubChem CID
3034331
DTXSID
DTXSID80944458
EC Number
244-615-4
Nikkaji
J225.459J

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
71.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
11
Heavy atoms
23
Formal charge
0
Complexity
400

Chemistry & industry

Suppliers2 total

陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]

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Compound notes

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