Basic information
- CAS
852237-34-4- Standard SMILES
CC(=O)C1CN(Cc2ccccc2)CCO1- InChIKey
HYFNBIVNYJGFJD-UHFFFAOYSA-N- Molecular formula
- C13H17NO2
- Average molar mass
- 219.28 g/mol
- Monoisotopic mass
- 219.12592879
Names & identifiers
- Preferred name
- 1-(4-Benzylmorpholin-2-yl)ethan-1-one
- IUPAC
- 1-(4-benzylmorpholin-2-yl)ethanone
- English name
- 1-(4-Benzylmorpholin-2-Yl)Ethan-1-One
- Molecular formula
- C13H17NO2
- Molecular weight
- 219.28
Names & synonyms
1-(4-benzylmorpholin-2-yl)ethan-1-one852237-34-4RefChem:424817996-112-01-(4-Benzylmorpholin-2-yl)ethanoneMFCD15142711Ethanone, 1-[4-(phenylmethyl)-2-morpholinyl]-SCHEMBL1759419CJB23734AKOS027255673AS-66722DB-215582
Show more names
1-[4-(phenylmethyl)morpholin-2-yl]ethan-1-one
CS-0261965EN300-80674W10865F505716
Database identifiers
- CAS
852237-34-4- PubChem CID
- 54594331
- EC Number
- 996-112-0
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 236
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, 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%)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers3 total
苏州美石生物科技有限公司1173954148q · [email protected]
药明览博(武汉)化学科技有限公司022-59987777 13552403979 · [email protected]
北京新研汇医药研发有限公司13969155946 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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