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Nonanediperoxoic acid, bis(1,1-dimethylethyl) ester

HCID 85497
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
16580-06-6
Standard SMILES
CC(C)(C)OOC(=O)CCCCCCCC(=O)OOC(C)(C)C
InChIKey
VMRTVQZUEDMYNS-UHFFFAOYSA-N
Molecular formula
C17H32O6
Average molar mass
332.4 g/mol
Monoisotopic mass
332.21988874

Names & identifiers

Preferred name
Nonanediperoxoic acid, bis(1,1-dimethylethyl) ester
IUPAC
ditert-butyl nonanediperoxoate
English name
di-tert-butyl diperoxyazelate
Molecular formula
C17H32O6
Molecular weight
332.43

Names & synonyms

Nonanediperoxoic acid, bis(1,1-dimethylethyl) ester16580-06-6EINECS 240-638-9Nonanediperoxoic acid, 1,9-bis(1,1-dimethylethyl) esterDTXSID5066083RefChem:854573DTXCID0035324ditert-butyl nonanediperoxoateDi-tert-butyl diperoxyazelatedi-tert-butyl nonanediperoxoateKayaester AZTrigonox 169OP50
Show more names
Di-tert.-butylperoxyazelatNonanediperoxoic acid di-tert-butyl esterHeptane-1,7-di(peroxycarboxylic acid)di-tert-butyl ester
di-tert-butyl peroxyazelatedi-t-butyl diperoxy-azelateBG5WG9N64ESCHEMBL2399659Di-tert-Butyl azelaoyl diperoxideNS000254271,9-Bis(1,1-dimethylethyl) nonanediperoxoate

Database identifiers

CAS
16580-06-6
PubChem CID
85497
DTXSID
DTXSID5066083
UNII
BG5WG9N64E
EC Number
240-638-9
Nikkaji
J127.848G

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
71.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
14
Heavy atoms
23
Formal charge
0
Complexity
317

Physicochemical properties

Boiling point
377.1 · 377.1±52.0 °C(Predicted)
Density
0.9914 g/cm3 · 0.9914 g/cm3(Temp: 25 °C)
EPA Substance Registry System
Nonanediperoxoic acid, bis(1,1-dimethylethyl) ester (16580-06-6)
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Hazard information

Regulatory InformationChemical: Nonanediperoxoic acid, bis(1,1-dimethylethyl) ester
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationNonanediperoxoic acid, 1,9-bis(1,1-dimethylethyl) ester: INACTIVE

Suppliers3 total

陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
SUZHOU SENFEIDA CHEMICAL CO.,LTD+86-0512-83500002 +86-15195660023 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes