2,6-Dimethylanthracene
Basic information
- CAS
613-26-3- Standard SMILES
Cc1ccc2cc3cc(C)ccc3cc2c1- InChIKey
AYRABHFHMLXKBT-UHFFFAOYSA-N- Molecular formula
- C16H14
- Average molar mass
- 206.28 g/mol
- Monoisotopic mass
- 206.10955045
Names & identifiers
- Preferred name
- 2,6-Dimethylanthracene
- IUPAC
- 2,6-dimethylanthracene
- English name
- 2,6-dimethylanthracene
- Molecular formula
- C16H14
- Molecular weight
- 206.28
Names & synonyms
2,6-DIMETHYLANTHRACENE613-26-3EINECS 210-333-5KGV46KF5ENAnthracene, 2,6-dimethyl-DTXSID70210194RefChem:83305DTXCID70132685210-333-52,6-Dimethyl-anthracenUNII-KGV46KF5ENSCHEMBL819377
Show more names
SCHEMBL4368477SCHEMBL11026596SCHEMBL27639240SCHEMBL31612403AYRABHFHMLXKBT-UHFFFAOYSA-NAKOS030239762DB-302546NS00034642
Database identifiers
- CAS
613-26-3- PubChem CID
- 11939
- DTXSID
DTXSID70210194- UNII
- KGV46KF5EN
- EC Number
- 210-333-5
- Nikkaji
- J135.642I
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 218
Physicochemical properties
- Melting point
- 228 · 228-238°C
- Boiling point
- 369.6 · 369.6±12.0 °C(Predicted)
- Density
- 1.084 · 1.084±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · -20°C Freezer
- solubility
- Chloroform (Slightly), Ethyl Acetate (Slightly)
- form
- Solid
- color
- Light Yellow
- FDA UNII
- 46 KF5EN · KGV46KF5EN
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
P273, P391, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAquatic Acute 1 (100%)
Chemistry & industry
Applications
Uses2,6-Dimethylanthracene (cas# 613-26-3) is a compound useful in organic synthesis.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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