8-Methyl-2-(2-methylphenyl)quinoline
Basic information
- CAS
76890-10-3- Standard SMILES
Cc1ccccc1-c1ccc2cccc(C)c2n1- InChIKey
VSMKVRALQUJRDN-UHFFFAOYSA-N- Molecular formula
- C17H15N
- Average molar mass
- 233.31 g/mol
- Monoisotopic mass
- 233.12044948
Names & identifiers
- Preferred name
- 8-Methyl-2-(2-methylphenyl)quinoline
- IUPAC
- 8-methyl-2-(2-methylphenyl)quinoline
- English name
- Quinoline, 8-methyl-2-(2-methylphenyl)-
- Molecular formula
- C17H15N
- Molecular weight
- 233.31
Names & synonyms
8-Methyl-2-(2-methylphenyl)quinolineTimTec1_005598VSMKVRALQUJRDN-UHFFFAOYSA-NHMS1549O10STK752156Quinoline, 8-methyl-2-(2-tolyl)-8-METHYL-2-O-TOLYL-QUINOLINEAKOS001722638NCGC00173065-01NCGC00173065-028-Methyl-2-(2-methylphenyl)quinoline #Quinoline, 8-methyl-2-(2-methylphenyl)-
Show more names
ST4019793EU-0051121ST45325139AB01325704-02SR-01000512267SR-01000512267-176890-10-3
Database identifiers
- CAS
76890-10-3- PubChem CID
- 616095
- EC Number
- 157-541-1
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 275
Physicochemical properties
- Boiling point
- 374.8 · 374.8±11.0 °C(Predicted)
- Density
- 1.087 · 1.087±0.06 g/cm3(Predicted)
- pka
- 5.42 · 5.42±0.10(Predicted)
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
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P273, P280, P301+P316, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, 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 CategoriesAcute Tox. 3 (100%)
Suppliers
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Related reactions
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Compound notes
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