Basic information
- CAS
65656-20-4- Standard SMILES
CC(CBr)(OCCOCCO)c1ccccc1- InChIKey
JVTJRTZLSRGTOH-UHFFFAOYSA-N- Molecular formula
- C13H19BrO3
- Average molar mass
- 303.19 g/mol
- Monoisotopic mass
- 302.05176
Names & identifiers
- Preferred name
- 2-{2-[(1-Bromo-2-phenylpropan-2-yl)oxy]ethoxy}ethan-1-ol
- IUPAC
- 2-[2-(1-bromo-2-phenylpropan-2-yl)oxyethoxy]ethanol
Names & synonyms
65656-20-4DTXSID104951452-{2-[(1-Bromo-2-phenylpropan-2-yl)oxy]ethoxy}ethan-1-ol
Database identifiers
- CAS
65656-20-4- PubChem CID
- 12376620
- DTXSID
DTXSID10495145
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 195
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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