2,7-Dichloro-3,8-dimethylquinoline
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Basic information
- CAS
108097-00-3- Standard SMILES
Cc1cc2ccc(Cl)c(C)c2nc1Cl- InChIKey
IRUZMQBGFICXJN-UHFFFAOYSA-N- Molecular formula
- C11H9Cl2N
- Average molar mass
- 226.1 g/mol
- Monoisotopic mass
- 225.0112047
Names & identifiers
- Preferred name
- 2,7-Dichloro-3,8-dimethylquinoline
- IUPAC
- 2,7-dichloro-3,8-dimethylquinoline
- English name
- 2,7-DICHLORO-3,8-DIMETHYLQUINOLINE
- Molecular formula
- C11H9Cl2N
- Molecular weight
- 226.1
Names & synonyms
2,7-Dichloro-3,8-dimethylquinoline108097-00-3DTXSID10588940RefChem:248747DTXCID00539704824-297-9MFCD097875442,7-dichloro-3,8-dimethyl-quinolineSCHEMBL9730937IRUZMQBGFICXJN-UHFFFAOYSA-NIEA09700AKOS012534809
Show more names
OTAVA-BB 1151724Quinoline, 2,7-dichloro-3,8-dimethyl-
AB51642DB-059684EN300-630338G46360
Database identifiers
- CAS
108097-00-3- PubChem CID
- 17039677
- DTXSID
DTXSID10588940- EC Number
- 824-297-9
Properties
Computed structural propertiesFilling in
- XLogP
- 4.5
- 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
- 338.3 · 338.3±37.0 °C(Predicted)
- Density
- 1.305 · 1.305±0.06 g/cm3(Predicted)
- pka
- -1.04 · -1.04±0.50(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335-H302-H332-H312
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P261-P271-P304+P340-P312-P280-P302+P352-P312-P322-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+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. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335-H302-H332-H312
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P261-P271-P304+P340-P312-P280-P302+P352-P312-P322-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362-P264-P270-P301+P312-P330-P501
Related reactions
2 records
Compound notes
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