Bicyclo[2.2.2]oct-5-en-2-ol, 1(or 4)-methyl-4(or 1)-(1-methylethyl)-, 2-acetate
Basic information
- CAS
1005255-03-7- Standard SMILES
CC(=O)OC1CC2(C(C)C)C=CC1(C)CC2- InChIKey
HBPZRWRMJZYDMS-UHFFFAOYSA-N- Molecular formula
- C14H22O2
- Average molar mass
- 222.32 g/mol
- Monoisotopic mass
- 222.16197994
Names & identifiers
- Preferred name
- Bicyclo[2.2.2]oct-5-en-2-ol, 1(or 4)-methyl-4(or 1)-(1-methylethyl)-, 2-acetate
- IUPAC
- (1-methyl-4-propan-2-yl-2-bicyclo[2.2.2]oct-5-enyl) acetate
Names & synonyms
EINECS 273-653-468991-89-9Acetoxy-1-methyl-4-isopropylbicyclo(2.2.2)oct-5-eneBicyclo(2.2.2)oct-5-en-2-ol, 1(or 4)-methyl-4(or 1)-(1-methylethyl)-, 2-acetateBicyclo[2.2.2]oct-5-en-2-ol, 1(or 4)-methyl-4(or 1)-(1-methylethyl)-, 2-acetateRefChem:119699Bicyclo(2.2.2)oct-5-en-2-ol, 1(or 4)-methyl-4(or 1)-(1-methylethyl)-, acetateBicyclo[2.2.2]oct-5-en-2-ol, 1(or 4)-methyl-4(or 1)-(1-methylethyl)-, acetate1-methyl-4-(propan-2-yl)bicyclo[2.2.2]oct-5-en-2-yl acetate1(Or4)-methyl-4(or1)-(1-methylethyl)bicyclo(2.2.2)oct-5-en-2-yl acetateDTXSID501017447NS00121836
Show more names
1-Methyl-4-(2-propanyl)bicyclo[2.2.2]oct-5-en-2-yl acetate1005255-03-7
Database identifiers
- CAS
1005255-03-7、68991-89-9- PubChem CID
- 112133
- DTXSID
DTXSID501017447- EC Number
- 273-653-4
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 332
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBicyclo[2.2.2]oct-5-en-2-ol, 1(or 4)-methyl-4(or 1)-(1-methylethyl)-, 2-acetate: INACTIVE
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Related reactions
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Compound notes
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