Basic information
- CAS
77026-83-6- Standard SMILES
C=C(C)C1CCC(=C)C(OO)C1- InChIKey
CSOZFPOODGAASP-UHFFFAOYSA-N- Molecular formula
- C10H16O2
- Average molar mass
- 168.23 g/mol
- Monoisotopic mass
- 168.11502975
Names & identifiers
- Preferred name
- 2-Methylidene-5-(prop-1-EN-2-YL)cyclohexane-1-peroxol
- IUPAC
- 2-hydroperoxy-1-methylidene-4-prop-1-en-2-ylcyclohexane
- English name
- p-menthadienhydroperoxide,(E)-p-mentha-1(7),8-dien-2-hydroperoxide
- Molecular formula
- C10H16O2
- Molecular weight
- 168.23
Names & synonyms
(2S,4R)-p-Mentha-[1(7),8]-diene 2-hydroperoxideCSOZFPOODGAASP-UHFFFAOYSA-NDTXSID4010174942-METHYLIDENE-5-(PROP-1-EN-2-YL)CYCLOHEXANE-1-PEROXOL(Z)-p-mentha-1,8-dien-2-hydroperoxide5-Isopropenyl-2-methylenecyclohexyl hydroperoxide #77026-83-6p-menthadienhydroperoxide,(E)-p-mentha-1(7),8-dien-2-hydroperoxideHydroperoxide, (1R,5S)-2-methylene-5-(1-methylethenyl)cyclohexyl (9CI)
Database identifiers
- CAS
77026-83-6- PubChem CID
- 564367
- DTXSID
DTXSID401017494- Nikkaji
- J160.292F
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 196
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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