Basic information
- CAS
497945-69-4- Standard SMILES
C=CCCC1(CBr)CCc2ccccc2C1=O- InChIKey
KJQQTXVCGDUJJY-UHFFFAOYSA-N- Molecular formula
- C15H17BrO
- Average molar mass
- 293.2 g/mol
- Monoisotopic mass
- 292.04628
Names & identifiers
- Preferred name
- 1(2H)-Naphthalenone, 2-(bromomethyl)-2-(3-butenyl)-3,4-dihydro-
- IUPAC
- 2-(bromomethyl)-2-but-3-enyl-3,4-dihydronaphthalen-1-one
Names & synonyms
1(2H)-Naphthalenone, 2-(bromomethyl)-2-(3-butenyl)-3,4-dihydro-497945-69-4DTXSID404696322-(Bromomethyl)-2-(but-3-en-1-yl)-3,4-dihydronaphthalen-1(2H)-one
Database identifiers
- CAS
497945-69-4- PubChem CID
- 11623462
- DTXSID
DTXSID40469632- Nikkaji
- J1.770.984D
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 299
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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