2-Cyclopropyl-2-ethoxyacetic acid
Basic information
- CAS
1482078-19-2- Standard SMILES
CCOC(C(=O)O)C1CC1- InChIKey
VWKJBQQBGVSYSK-UHFFFAOYSA-N- Molecular formula
- C7H12O3
- Average molar mass
- 144.17 g/mol
- Monoisotopic mass
- 144.07864424
Names & identifiers
- Preferred name
- 2-Cyclopropyl-2-ethoxyacetic acid
- IUPAC
- 2-cyclopropyl-2-ethoxyacetic acid
- English name
- 2-cyclopropyl-2-ethoxyacetic acid
- Molecular formula
- C7H12O3
- Molecular weight
- 144.16838
Names & synonyms
2-cyclopropyl-2-ethoxyacetic acid1482078-19-2RefChem:471110891-192-2SCHEMBL142344112-cyclopropyl-2-ethoxyaceticacid2-cyclopropyl-2-ethoxy-acetic acidHJC07819AKOS015021774CS-0245791E73033EN300-311527
Show more names
Cyclopropaneacetic acid, α-ethoxy-
Database identifiers
- CAS
1482078-19-2- PubChem CID
- 65682191
- EC Number
- 891-192-2
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 129
Physicochemical properties
- Boiling point
- 268.4 · 268.4±13.0 °C(Predicted)
- Density
- 1.173 · 1.173±0.06 g/cm3(Predicted)
- pka
- 3.51 · 3.51±0.10(Predicted)
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%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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