6,6-Dimethylbicyclo[3.1.1]hept-2-ene-2-carbonyl chloride
Basic information
- CAS
146254-24-2- Standard SMILES
CC1(C)C2CC=C(C(=O)Cl)C1C2- InChIKey
OFMPGNCKUYNNHY-UHFFFAOYSA-N- Molecular formula
- C10H13ClO
- Average molar mass
- 184.66 g/mol
- Monoisotopic mass
- 184.0654927
Names & identifiers
- Preferred name
- 6,6-Dimethylbicyclo[3.1.1]hept-2-ene-2-carbonyl chloride
- IUPAC
- 6,6-dimethylbicyclo[3.1.1]hept-2-ene-2-carbonyl chloride
- English name
- Bicyclo[3.1.1]hept-2-ene-2-carbonyl chloride, 6,6-dimethyl- (9CI)
- Molecular formula
- C10H13ClO
- Molecular weight
- 184.66
Names & synonyms
146254-24-26,6-Dimethylbicyclo[3.1.1]hept-2-ene-2-carbonyl chlorideMyrtene acid chlorideBicyclo[3.1.1]hept-2-ene-2-carbonyl chloride, 6,6-dimethyl- (9CI)DTXSID60341183OFMPGNCKUYNNHY-UHFFFAOYSA-N6,6-Dimethylbicyclo[3.1.1]hept-2-ene-2-carbonyl chloride #Bicyclo[3.1.1]hept-2-ene-2-carbonyl chloride, 6,6-dimethyl-
Database identifiers
- CAS
146254-24-2- PubChem CID
- 570873
- DTXSID
DTXSID60341183- Nikkaji
- J524.159F
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 265
Physicochemical properties
- Boiling point
- 238.6 · 238.6±7.0 °C(Predicted)
- Density
- 1.146 · 1.146±0.06 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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