5,8-Diazaspiro(3.5)nonan-6-one
Basic information
- CAS
1419209-31-6- Standard SMILES
O=C1CNCC2(CCC2)N1- InChIKey
TWGRGYAXVAYVJF-UHFFFAOYSA-N- Molecular formula
- C7H12N2O
- Average molar mass
- 140.18 g/mol
- Monoisotopic mass
- 140.09496301
Names & identifiers
- Preferred name
- 5,8-Diazaspiro(3.5)nonan-6-one
- IUPAC
- 5,8-diazaspiro[3.5]nonan-6-one
- English name
- 5,8-diazaspiro[3.5]nonan-6-one
- Molecular formula
- C7H12N2O
- Molecular weight
- 140.18
Names & synonyms
5,8-Diazaspiro[3.5]nonan-6-one1419209-31-65,8-Diazaspiro(3.5)nonan-6-oneRefChem:528318842-127-1MFCD31567418AKOS037644477SB10824AS-53764SY233768CS-0050718P17078
Show more names
EN300-2009149UGC20931F538883
Database identifiers
- CAS
1419209-31-6- PubChem CID
- 72208232
- EC Number
- 842-127-1
Properties
Computed structural properties
- XLogP
- -0.4
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 163
Physicochemical properties
- Boiling point
- 352.9 · 352.9±35.0 °C(Predicted)
- Density
- 1.16 · 1.16±0.1 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C, protect from light
- pka
- 15.36 · 15.36±0.20(Predicted)
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 335 · H335-H315-H318
- Precautionary statements
- 280 · P280-P305+P351+P338-P310-P264-P280-P302+P352-P321-P332+P313-P362
- HS Code
- 2933998090 · 2933998090
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, 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 CategoriesSkin Irrit. 2 (100%)
Safety data
- hs_code
- 2933998090
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H335-H315-H318
- Precautionary statements
- P280-P305+P351+P338-P310-P264-P280-P302+P352-P321-P332+P313-P362
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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