Basic information
- CAS
1512222-32-0- Standard SMILES
c1ccc(CN2CCC3OCCNC3C2)cc1- InChIKey
NQOZBPSEWFZGRL-UHFFFAOYSA-N- Molecular formula
- C14H20N2O
- Average molar mass
- 232.32 g/mol
- Monoisotopic mass
- 232.15756327
Names & identifiers
- Preferred name
- 6-benzyl-octahydro-2H-pyrido[4,3-b]morpholine
- IUPAC
- 6-benzyl-2,3,4,4a,5,7,8,8a-octahydropyrido[4,3-b][1,4]oxazine
Names & synonyms
6-Benzyl-octahydro-2H-pyrido[4,3-b]morpholine1512222-32-06-benzyl-octahydro-2H-pyrido(4,3-b)morpholineRefChem:540462994-826-76-benzyl-2,3,4,4a,5,7,8,8a-octahydropyrido[4,3-b][1,4]oxazineMKC22232EN300-262460
Database identifiers
- CAS
1512222-32-0- PubChem CID
- 83487362
- EC Number
- 994-826-7
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 24.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 240
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%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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