3-(2-Ethylbutoxy)propanoic acid
Basic information
- CAS
10213-74-8- Standard SMILES
CCC(CC)COCCC(=O)O- InChIKey
ZLPVZWUOBAHGNY-UHFFFAOYSA-N- Molecular formula
- C9H18O3
- Average molar mass
- 174.24 g/mol
- Monoisotopic mass
- 174.12559443
Names & identifiers
- Preferred name
- 3-(2-Ethylbutoxy)propanoic acid
- IUPAC
- 3-(2-ethylbutoxy)propanoic acid
- English name
- 3-(2-ethylbutoxy)propionic acid
- Molecular formula
- C9H18O3
- Molecular weight
- 174.24
Names & synonyms
3-(2-ethylbutoxy)propanoic acid10213-74-83-(2-Ethylbutoxy)propionic acidPropionic acid, 3-(2-ethylbutoxy)-VQN2L8EVQ2DTXSID20144677RefChem:1066526DTXCID7067168233-518-2Propanoic acid, 3-(2-ethylbutoxy)-BRN 1757593EINECS 233-518-2
Show more names
Kyselina 3-(2-ethylbutoxy)propionova [Czech]3-(2-Ethylbutoxy) propionic acidKyselina 3-(2-ethylbutoxy)propionovaZLPVZWUOBAHGNY-UHFFFAOYSA-NAKOS006278717NS00023112
Database identifiers
- CAS
10213-74-8- PubChem CID
- 61493
- DTXSID
DTXSID20144677- UNII
- VQN2L8EVQ2
- EC Number
- 233-518-2
- Nikkaji
- J35.368J
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 119
Physicochemical properties
- Boiling point
- 245.22 °C · 245.22°C (rough estimate)
- Density
- 1.0069 · 1.0069 (rough estimate)
- refractive index
- 1.43 · 1.4300 (estimate)
- pka
- 4.31 · 4.31±0.10(Predicted)
Chemistry & industry
Applications
UsesPreparation of metallic salts for paint driers and gelling agents.
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Compound notes
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