8,13-Dioxa-2,11-diazadispiro(3.0.5^(5).3^(4))tridecan-12-one hydrochloride
Basic information
- CAS
2225144-03-4- Standard SMILES
Cl.O=C1NC2(CCOCC2)C2(CNC2)O1- InChIKey
KHBNLFCDEHPRPR-UHFFFAOYSA-N- Molecular formula
- C9H15ClN2O3
- Average molar mass
- 234.68 g/mol
- Monoisotopic mass
- 234.07712
Names & identifiers
- Preferred name
- 8,13-Dioxa-2,11-diazadispiro(3.0.5^(5).3^(4))tridecan-12-one hydrochloride
- IUPAC
- 8,13-dioxa-2,11-diazadispiro[3.0.55.34]tridecan-12-one;hydrochloride
Names & synonyms
2225144-03-48,13-dioxa-2,11-diazadispiro[3.0.5^{5}.3^{4}]tridecan-12-one hydrochloride8,13-Dioxa-2,11-diazadispiro(3.0.5^(5).3^(4))tridecan-12-one hydrochlorideRefChem:547155973-162-18,13-Dioxa-2,11-diazadispiro[3.0.55.34]tridecan-12-one;hydrochloride8,13-dioxa-2,11-diazadispiro[3.0.5?.3?]tridecan-12-one hydrochlorideAPD144038,13-Dioxa-2,11-diazadispiro[3.0.55.34]tridecan-12-one hydrochlorideEN300-17161898,13-Dioxa-2,11-diazadispiro[3.0.5{5}.3{4}]tridecan-12-one hydrochloride
Database identifiers
- CAS
2225144-03-4- PubChem CID
- 137963979
- EC Number
- 973-162-1
Properties
Computed structural properties
- Topological polar surface area
- 59.6 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 269
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%)
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Compound notes
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