4,7-Dichloro-2,8-dimethylquinoline
Basic information
- CAS
21728-15-4- Standard SMILES
Cc1cc(Cl)c2ccc(Cl)c(C)c2n1- InChIKey
FGFQQASKLBXKQZ-UHFFFAOYSA-N- Molecular formula
- C11H9Cl2N
- Average molar mass
- 226.1 g/mol
- Monoisotopic mass
- 225.0112047
Names & identifiers
- Preferred name
- 4,7-Dichloro-2,8-dimethylquinoline
- IUPAC
- 4,7-dichloro-2,8-dimethylquinoline
- English name
- 4,7-Dichloro-2,8-dimethylquinoline
- Molecular formula
- C11H9Cl2N
- Molecular weight
- 226.1
Names & synonyms
4,7-Dichloro-2,8-dimethylquinoline21728-15-4MFCD00272342NSC19460DTXSID60280967WLZ3971NSC-19460AKOS002673953AB05624BS-23198SY227394DB-066612
Show more names
4,7-DICHLORO-8-METHYLQUINALDINEQuinoline, 4,7-dichloro-2,8-dimethyl-
CS-0449774F752924,7-Dichloro-2,8-dimethylquinoline, AldrichCPRF772047SR-01000473566SR-01000473566-1
Database identifiers
- CAS
21728-15-4- PubChem CID
- 227602
- DTXSID
DTXSID60280967- EC Number
- 803-146-0
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 12.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 209
Physicochemical properties
- Boiling point
- 317.1 · 317.1±37.0 °C(Predicted)
- Density
- 1.305 · 1.305±0.06 g/cm3(Predicted)
- storage temp.
- Store at room temperature
- pka
- 2.86 · 2.86±0.50(Predicted)
- Appearance
- Off-white to light brown Solid
- Comptox DTXSID
- 60280967 · DTXSID60280967
- Symbol(GHS)
- 5 · GHS05,GHS06
- Signal word
- Danger
- Hazard statements
- 301 · H301-H318-H413
- Precautionary statements
- 280 · P280-P301+P310-P305+P351+P338
- Hazard Codes
- T
- Risk Statements
- 25 · 25-41
- Safety Statements
- 26 · 26-39-45
- RIDADR
- 2811 · UN 2811 6.1 / PGIII
- WGK Germany
- 3 · 3
- HS Code
- 2933499090 · 2933499090
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]
P264, P264+P265, P270, P273, P280, P301+P316, P305+P354+P338, P317, P321, P330, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (100%)
Safety data
- wgk
- 3
- ridadr
- UN 2811 6.1 / PGIII
- hs_code
- 2933499090
- risk_code
- 25-41
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS06
- hazard_code
- T
- safety_code
- 26-39-45
- Hazard statements
- H301-H318-H413
- Precautionary statements
- P280-P301+P310-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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