Basic information
- CAS
6304-68-3- Standard SMILES
CC(C)(C(=O)Cc1ccccc1)c1ccccc1- InChIKey
BBTWUMZHDIKGCQ-UHFFFAOYSA-N- Molecular formula
- C17H18O
- Average molar mass
- 238.32 g/mol
- Monoisotopic mass
- 238.13576519
Names & identifiers
- Preferred name
- 3-Methyl-1,3-diphenylbutan-2-one
- IUPAC
- 3-methyl-1,3-diphenylbutan-2-one
Names & synonyms
3-methyl-1,3-diphenylbutan-2-one6304-68-3DTXSID50285845RefChem:1068157DTXCID30236996NSC429933-methyl-1,3-diphenyl-butan-2-oneSCHEMBL1195864NSC-42993AKOS012384651DS-014267
Database identifiers
- CAS
6304-68-3- PubChem CID
- 238560
- DTXSID
DTXSID50285845
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
- 18
- Formal charge
- 0
- Complexity
- 267
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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