Oxirane, 2-(chloromethyl)-2-(1-methylethenyl)-
Basic information
- CAS
121505-32-6- Standard SMILES
C=C(C)C1(CCl)CO1- InChIKey
NQTKBQXFYLCEGH-UHFFFAOYSA-N- Molecular formula
- C6H9ClO
- Average molar mass
- 132.59 g/mol
- Monoisotopic mass
- 132.0341926
Names & identifiers
- Preferred name
- Oxirane, 2-(chloromethyl)-2-(1-methylethenyl)-
- IUPAC
- 2-(chloromethyl)-2-prop-1-en-2-yloxirane
Names & synonyms
NQTKBQXFYLCEGH-UHFFFAOYSA-NDTXSID201361316AKOS0063878632-(Chloromethyl)-2-isopropenyloxirane #(r,s)-2-chloromethyl-2-isopropenyl-oxirane2-(Chloromethyl)-2-(1-methylethenyl)oxiraneOxirane, 2-(chloromethyl)-2-(1-methylethenyl)-121505-32-6
Database identifiers
- CAS
121505-32-6- PubChem CID
- 548965
- DTXSID
DTXSID201361316
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 122
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Compound notes
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