4-Ethoxyphenol

• Catalog Number: ACM622628
• Product Name: 4-Ethoxyphenol
• CAS: 622-62-8
• Category: Phenols
• Description: Solid;White or colourless crystals, sweet herbaceous odour reminiscent of anise and fennel
• Synonyms: Hydroquinone Monoethyl Ether
• IUPAC Name: 4-ethoxyphenol
• Molecular Weight: 138.16
• Molecular Formula: C8H10O2
• Canonical SMILES: CCOC1=CC=C(O)C=C1
• InChI: InChI=1S/C8H10O2/c1-2-10-8-5-3-7(9)4-6-8/h3-6,9H,2H2,1H3
• InChI Key: LKVFCSWBKOVHAH-UHFFFAOYSA-N
• Boiling Point: 121 °C (lit.) at 9 mmHg
• Melting Point: 64-67 ºC
• Density: 1.0742 g/ml
• Solubility: slightly soluble to soluble in water; soluble in oils;moderately soluble (in ethanol)
• Appearance: Crystalline or crystalline powder or chunks
• Storage: Store under inert gas
• Complexity: 85.3
• Covalently-Bonded Unit Count: 1
• EC Number: 210-748-1
• Exact Mass: 138.06808g/mol
• Formal Charge: 0
• Hazard Statements: H315 : Causes skin irritation.H319 : Causes serious eye irritation.
• H-Bond Acceptor: 2
• H-Bond Donor: 1
• Heavy Atom Count: 10
• LogP: 1.81 (LogP);1.81;1.81
• MDL Number: MFCD00002334
• Monoisotopic Mass: 138.06808g/mol
• NSC Number: 9885
• pKa: pKa1 10.13 (25 °)
• Precautionary Statements: P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.
• Rotatable Bond Count: 2
• Signal Word: Warning
• Symbol: GHS05
• UNII: 605352N8AQ
• XLogP3: 1.8

Custom Q&A

What is the molecular formula of 4-Ethoxyphenol?

The molecular formula of 4-Ethoxyphenol is C8H10O2.

What is the molecular weight of 4-Ethoxyphenol?

The molecular weight of 4-Ethoxyphenol is 138.16 g/mol.

What is the IUPAC name of 4-Ethoxyphenol?

The IUPAC name of 4-Ethoxyphenol is 4-ethoxyphenol.

What is the InChI of 4-Ethoxyphenol?

The InChI of 4-Ethoxyphenol is InChI=1S/C8H10O2/c1-2-10-8-5-3-7(9)4-6-8/h3-6,9H,2H2,1H3.

What is the InChIKey of 4-Ethoxyphenol?

The InChIKey of 4-Ethoxyphenol is LKVFCSWBKOVHAH-UHFFFAOYSA-N.

What is the canonical SMILES of 4-Ethoxyphenol?

The canonical SMILES of 4-Ethoxyphenol is CCOC1=CC=C(C=C1)O.

What is the CAS number of 4-Ethoxyphenol?

The CAS number of 4-Ethoxyphenol is 622-62-8.

What is the European Community (EC) number of 4-Ethoxyphenol?

The European Community (EC) number of 4-Ethoxyphenol is 210-748-1.

What is the FEMA number of 4-Ethoxyphenol?

The FEMA number of 4-Ethoxyphenol is 3695.