6-(Dimethylamino)-2-methylquinolin-4-ol
Basic information
- CAS
91566-30-2- Standard SMILES
Cc1cc(=O)c2cc(N(C)C)ccc2[nH]1- InChIKey
XAWXYXWRJBIQPZ-UHFFFAOYSA-N- Molecular formula
- C12H14N2O
- Average molar mass
- 202.25 g/mol
- Monoisotopic mass
- 202.11061307
Names & identifiers
- Preferred name
- 6-(Dimethylamino)-2-methylquinolin-4-ol
- IUPAC
- 6-(dimethylamino)-2-methyl-1H-quinolin-4-one
- English name
- 6-(dimethylamino)-2-methylquinolin-4-ol
- Molecular formula
- C12H14N2O
- Molecular weight
- 202.25
Names & synonyms
6-(dimethylamino)-2-methylquinolin-4-ol91566-30-26-(dimethylamino)-2-methyl-1H-quinolin-4-oneNSC208728F3099-62776-(dimethylamino)-2-methyl-4-quinolinolMFCD05743584starbld0009339SCHEMBL28388145SMSSF-0535961SBB016279AKOS000273762
Show more names
4-Quinolinol, 6-(dimethylamino)-2-methyl-
NSC-208728CS-0367260ST502081056-(Dimethylamino)-2-methylquinolin-4(1H)-oneAP-906/43238580
Database identifiers
- CAS
91566-30-2- PubChem CID
- 308138
- EC Number
- 809-578-6
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 296
Physicochemical properties
- Melting point
- 320 · 320-322 °C(Solv: ethanol (64-17-5); ethyl ether (60-29-7))
- Boiling point
- 382 · 382.0±37.0 °C(Predicted)
- Density
- 1.193 · 1.193±0.06 g/cm3(Predicted)
- pka
- 4 · 4+-.0.40(Predicted)
- form
- solid
- InChI
- 1S/C12H14N2O/c1-8-6-12(15)10-7-9(14(2)3)4-5-11(10)13-8/h4-7H,1-3H3,(H,13,15)
- InChIKey
- XAWXYXWRJBIQPZ-UHFFFAOYSA-N
- SMILES
- OC1=CC(C)=NC2=CC=C(N(C)C)C=C21
- UNSPSC Code
- 12352200 · 12352200
- NACRES
- 21 · NA.21
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501
- WGK Germany
- 3 · WGK 3
- Storage Class
- 11 · 11 - Combustible Solids
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]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- wgk
- WGK 3
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302
- Hazard Classifications
- Acute Tox. 4 Oral
- Precautionary statements
- P264-P270-P301+P312-P330-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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