Basic information
- CAS
2699-11-8- Standard SMILES
OOC1(OO)CCCCC1- InChIKey
KYDNMMZJQGVHQM-UHFFFAOYSA-N- Molecular formula
- C6H12O4
- Average molar mass
- 148.16 g/mol
- Monoisotopic mass
- 148.07355886
Overview
See also: [> 91 % Solution] (annotation moved to); Hydroperoxide, cyclohexylidenebis- (annotation moved to).
Names & identifiers
- Preferred name
- Cyclohexylidene hydroperoxide
- IUPAC
- 1,1-dihydroperoxycyclohexane
- English name
- cyclohexylidene hydroperoxide
- Molecular formula
- C6H12O4
- Molecular weight
- 148.15708
Names & synonyms
Cyclohexylidene hydroperoxideDTXSID00181484EINECS 220-279-41,1'-Cyclohexylidenebis[hydroperoxide]1,1'-Cyclohexylidenebis(hydroperoxide)RefChem:580863DTXCID10103975220-279-41,1-dihydroperoxycyclohexane2699-11-8CYCLOHEXANE-1,1-DIPEROXOLTKZ3YG7SNF
Show more names
CyclohexylidenebishydroperoxideCyclohexylidenebis(hydroperoxide)Hydroperoxide, cyclohexylidenebis-1,1-Cyclohexanediylbishydroperoxide
SCHEMBL374869AKOS015906210Hydroperoxide, 1,1'-cyclohexylidenebis-NS00020500
Database identifiers
- CAS
2699-11-8- PubChem CID
- 75911
- DTXSID
DTXSID00181484- UNII
- TKZ3YG7SNF
- EC Number
- 220-279-4
- Nikkaji
- J192.205J
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 58.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 91.9
Physicochemical properties
- RIDADR
- 3104 · 3104
- HazardClass
- 5.2 · 5.2
- PackingGroup
- II
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H242: Heating may cause a fire [Danger Self-reactive substances and mixtures; Organic peroxides]
P210, P234, P235, P240, P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, P370+P378, P403, P405, P410, P411, P420, and P501 (click each P-code to see the statement)
Danger
H240: Heating may cause an explosion [Danger Self-reactive substances and mixtures; Organic peroxides]
P210, P234, P235, P240, P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, P370+P372+P380+P373, P403, P405, P410, P411, P420, and P501 (click each P-code to see the statement)
Hazard information
Hazard Classes and Categories
Organic peroxide - type A
Organic peroxide - type C
Org. Perox. C
Safety data
- ridadr
- 3104
- hazard_class
- 5.2
- packing_group
- II
Related reactions
1 records
Compound notes
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