Basic information
- CAS
2876-35-9- Standard SMILES
CC(C)(C)c1ccc2ccccc2c1- InChIKey
MCEORGGPAKTORV-UHFFFAOYSA-N- Molecular formula
- C14H16
- Average molar mass
- 184.28 g/mol
- Monoisotopic mass
- 184.12520051
Names & identifiers
- Preferred name
- 2-tert-Butylnaphthalene
- IUPAC
- 2-tert-butylnaphthalene
- English name
- 2-tert-butylnaphthalene
- Molecular formula
- C14H16
- Molecular weight
- 184.28
Names & synonyms
2-tert-ButylnaphthaleneNaphthalene, 2-(1,1-dimethylethyl)-Naphthalene, 2-tert-butyl-.beta.-tert-Butylnaphthalene2-(1,1-Dimethylethyl)naphthaleneDTXSID90182945NSC 91462RefChem:89420beta-tert-ButylnaphthaleneDTXCID30105436InChI=1/C14H16/c1-14(2,3)13-9-8-11-6-4-5-7-12(11)10-13/h4-10H,1-3HMCEORGGPAKTORV-UHFFFAOYSA-N
Show more names
2876-35-92-(TERT-BUTYL)NAPHTHALENE2-tert-butyl-naphthaleneNSC914622-t-butylnaphthaleneNaphthalene,2-(1,1-dimethylethyl)-NCIOpen2_001454SCHEMBL599567
Database identifiers
- CAS
2876-35-9- PubChem CID
- 17889
- DTXSID
DTXSID90182945- Nikkaji
- J99.432D
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 187
Experimental & physicochemical properties
SpringerMaterials Properties13C nuclear magnetic resonance spectrum
Physicochemical properties
- Melting point
- -5 °C · -5°C
- Boiling point
- 281.65 °C · 281.65°C
- Density
- 0.9648 · 0.9648
- refractive index
- 1.574 · 1.5740
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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