4-(2,2-Dimethylmorpholin-4-yl)-2-methoxyaniline
Basic information
- CAS
1411418-67-1- Standard SMILES
COc1cc(N2CCOC(C)(C)C2)ccc1N- InChIKey
MKORQHDZQJCFMT-UHFFFAOYSA-N- Molecular formula
- C13H20N2O2
- Average molar mass
- 236.31 g/mol
- Monoisotopic mass
- 236.15247789
Names & identifiers
- Preferred name
- 4-(2,2-Dimethylmorpholin-4-yl)-2-methoxyaniline
- IUPAC
- 4-(2,2-dimethylmorpholin-4-yl)-2-methoxyaniline
- English name
- 4-(2,2-dimethylmorpholin-4-yl)-2-methoxyaniline
- Molecular formula
- C13H20N2O2
- Molecular weight
- 236.31
Names & synonyms
4-(2,2-dimethylmorpholin-4-yl)-2-methoxyaniline1411418-67-1RefChem:510651976-532-0LGC41867AKOS012980985CS-0223297EN300-1146534-(2,2-dimethylmorpholin-4-yl)-2-methoxy-anilineBenzenamine, 4-(2,2-dimethyl-4-morpholinyl)-2-methoxy-
Database identifiers
- CAS
1411418-67-1- PubChem CID
- 63669991
- EC Number
- 976-532-0
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 47.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 258
Physicochemical properties
- Boiling point
- 404 · 404.0±45.0 °C(Predicted)
- Density
- 1.086 · 1.086±0.06 g/cm3(Predicted)
- pka
- 7.5 · 7.50±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, 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. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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