2-(2-Phenylethyl)morpholine
Basic information
- CAS
58039-64-8- Standard SMILES
c1ccc(CCC2CNCCO2)cc1- InChIKey
TXIWKJLQPACJEW-UHFFFAOYSA-N- Molecular formula
- C12H17NO
- Average molar mass
- 191.27 g/mol
Names & identifiers
- Preferred name
- 2-(2-Phenylethyl)morpholine
- IUPAC
- 2-(2-phenylethyl)morpholine
- English name
- 2-(2-Phenylethyl)Morpholine
- Molecular formula
- C12H17NO
- Molecular weight
- 191.27
Names & synonyms
2-(2-phenylethyl)morpholine58039-64-8RefChem:454396873-336-62-PhenethylmorpholineMFCD09055010SCHEMBL780442-(beta-phenylethyl)morpholineSCHEMBL9050275Morpholine, 2-(2-phenylethyl)-TXIWKJLQPACJEW-UHFFFAOYSA-NICA03964
Show more names
AKOS006331153DA-04691NS-01805CS-0453863EN300-135402G65393F774753F2148-1688
Database identifiers
- CAS
58039-64-8- PubChem CID
- 19964397
- EC Number
- 873-336-6
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 21.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 154
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 335 · H335-H318-H332-H315-H312-H302
- Precautionary statements
- 264 · P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312-P280-P305+P351+P338-P310-P280-P302+P352-P312-P322-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362
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
- Danger
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H335-H318-H332-H315-H312-H302
- Precautionary statements
- P264-P270-P301+P312-P330-P501-P261-P271-P304+P340-P312-P280-P305+P351+P338-P310-P280-P302+P352-P312-P322-P363-P501-P264-P280-P302+P352-P321-P332+P313-P362
Chemistry & industry
Applications
Uses2-(2-Phenylethyl)morpholine is used to prepare 2,4-disubstituted morpholines that bind at at human D4 dopamine receptors.
Related reactions
4 records
Compound notes
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