Basic information
- CAS
22913-02-6- Standard SMILES
CCCCCCCCC(=O)OOC(C)(C)C- InChIKey
YSMATABRECEYRJ-UHFFFAOYSA-N- Molecular formula
- C13H26O3
- Average molar mass
- 230.34 g/mol
- Monoisotopic mass
- 230.18819469
Overview
Nonaneperoxoic acid, 1,1-dimethylethyl ester is a carbonyl compound.
Names & identifiers
- Preferred name
- tert-Butyl nonaneperoxoate
- IUPAC
- tert-butyl nonaneperoxoate
- English name
- tert-butyl nonaneperoxoate
- Molecular formula
- C13H26O3
- Molecular weight
- 230.34374
Names & synonyms
tert-Butyl nonaneperoxoate22913-02-6Nonaneperoxoic acid, 1,1-dimethylethyl esterEINECS 245-319-8Peroxynonanoic acid, tert-butyl esterTertbutyl perpelargonatet-Butyl peroxidenonanoatetert-Butyl nonaneperoxoate #SCHEMBL1322741DTXSID20177460CHEBI:229353NS00027296
Show more names
tert-Butyl pernonanoatetert-Butyl perpelargonateNonaneperoxoic acid 1,1-dimethylethyl ester
Database identifiers
- CAS
22913-02-6- PubChem CID
- 89899
- DTXSID
DTXSID20177460- ChEBI
CHEBI:229353- EC Number
- 245-319-8
- Nikkaji
- J106.499A
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 10
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 182
Chemistry & industry
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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