Basic information
- CAS
2003526-51-8- Standard SMILES
C=CC(=O)N1CCC2(CC1)CC2C(=O)O- InChIKey
YMDDLTYYBUUFPY-UHFFFAOYSA-N- Molecular formula
- C11H15NO3
- Average molar mass
- 209.24 g/mol
- Monoisotopic mass
- 209.10519334
Names & identifiers
- Preferred name
- 6-(Prop-2-enoyl)-6-azaspiro[2.5]octane-1-carboxylic acid
- IUPAC
- 6-prop-2-enoyl-6-azaspiro[2.5]octane-2-carboxylic acid
Names & synonyms
2003526-51-86-(Prop-2-enoyl)-6-azaspiro[2.5]octane-1-carboxylic acid6-(prop-2-enoyl)-6-azaspiro(2.5)octane-1-carboxylic acidRefChem:539852991-943-56-acryloyl-6-azaspiro[2.5]octane-1-carboxylic acidMFCD34755250SY424142Z2469905132
Database identifiers
- CAS
2003526-51-8- PubChem CID
- 166405851
- EC Number
- 991-943-5
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 57.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 316
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%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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