2-Hydroxy-2-{8-hydroxyspiro[4.5]decan-8-yl}acetic acid
Basic information
- CAS
2293003-88-8- Standard SMILES
O=C(O)C(O)C1(O)CCC2(CCCC2)CC1- InChIKey
GJZDDORHPVNFFD-UHFFFAOYSA-N- Molecular formula
- C12H20O4
- Average molar mass
- 228.28 g/mol
- Monoisotopic mass
- 228.13615911
Names & identifiers
- Preferred name
- 2-Hydroxy-2-{8-hydroxyspiro[4.5]decan-8-yl}acetic acid
- IUPAC
- 2-hydroxy-2-(8-hydroxyspiro[4.5]decan-8-yl)acetic acid
Names & synonyms
2293003-88-82-hydroxy-2-{8-hydroxyspiro[4.5]decan-8-yl}acetic acid
Database identifiers
- CAS
2293003-88-8- PubChem CID
- 178200151
- EC Number
- 155-118-6
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 77.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 271
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, 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 CategoriesSkin Irrit. 2 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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