Basic information
- CAS
23450-27-3- Standard SMILES
COc1cccc(Cc2ccccc2)c1- InChIKey
OJMXATJXHTWJDR-UHFFFAOYSA-N- Molecular formula
- C14H14O
- Average molar mass
- 198.26 g/mol
- Monoisotopic mass
- 198.10446507
Names & identifiers
- Preferred name
- 1-Benzyl-3-methoxybenzene
- IUPAC
- 1-benzyl-3-methoxybenzene
Names & synonyms
1-Benzyl-3-methoxybenzene23450-27-3Benzene, 1-methoxy-3-(phenylmethyl)-3-Methoxydiphenlymethane1-Benzyl-3-methoxybenzene #SCHEMBL746054SCHEMBL2032358SCHEMBL2092571SCHEMBL2092574SCHEMBL3301399SCHEMBL6978758SCHEMBL6978760
Show more names
SCHEMBL7019024SCHEMBL8939754SCHEMBL31739258DTXSID60345883OJMXATJXHTWJDR-UHFFFAOYSA-NMFCD34860552H70253
Database identifiers
- CAS
23450-27-3- PubChem CID
- 607759
- DTXSID
DTXSID60345883- Nikkaji
- J810.403D
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 172
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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