Basic information
- CAS
38641-17-7- Standard SMILES
CC(C)(C)Cc1cccc2ccccc12- InChIKey
KUQOKOVUZSOFGP-UHFFFAOYSA-N- Molecular formula
- C15H18
- Average molar mass
- 198.3 g/mol
- Monoisotopic mass
- 198.14085057
Names & identifiers
- Preferred name
- (tert-Butyl)methylnaphthalene
- IUPAC
- 1-(2,2-dimethylpropyl)naphthalene
- English name
- (tert-butyl)methylnaphthalene
- Molecular formula
- C15H18
- Molecular weight
- 198.30342
Names & synonyms
(tert-Butyl)methylnaphthaleneEINECS 254-055-238641-17-71-(2,2-dimethylpropyl)naphthaleneSCHEMBL4814070SCHEMBL4814074SCHEMBL11586023DTXSID20959480NS00057349
Database identifiers
- CAS
38641-17-7- PubChem CID
- 3016000
- DTXSID
DTXSID20959480- EC Number
- 254-055-2
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 199
Experimental & physicochemical properties
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
Chemistry & industry
Suppliers1 total
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Related reactions
0 records
No reaction records under the current filter.
Compound notes
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