Basic information
- CAS
29568-65-8- Standard SMILES
CC(Br)C1(c2ccccc2)OCCO1- InChIKey
XVCCETUPKGWPKC-UHFFFAOYSA-N- Molecular formula
- C11H13BrO2
- Average molar mass
- 257.12 g/mol
- Monoisotopic mass
- 256.00989
Names & identifiers
- Preferred name
- 2-(1-Bromoethyl)-2-phenyl-1,3-dioxolane
- IUPAC
- 2-(1-bromoethyl)-2-phenyl-1,3-dioxolane
Names & synonyms
29568-65-82-(1-bromoethyl)-2-phenyl-1,3-dioxolaneNSC142324SCHEMBL3895160DTXSID10301318NSC-142324
Database identifiers
- CAS
29568-65-8- PubChem CID
- 285441
- DTXSID
DTXSID10301318- Nikkaji
- J2.039.338F
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 184
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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