4-Hexylphenol

• CAS: 2446-69-7
• Catalog Number: ACM2446697
• Category: Arenes
• Molecular Weight: 178.27
• Molecular Formula: C₈H₁₆ClN
• Synonyms: 4-n-Hexylphenol, p-Hexylphenol, Phenol, 4-hexyl-, p-n-Hexylphenol, Phenol, p-hexyl-, 4-HEXYLPHENOL, Diisopropyl azodicarboxylate, CID17132, EINECS 219-501-2, ZINC01577480, TL8002009, EU-0034692, LT03510421, C14465, 2446-69-7
• IUPAC Name: 4-hexylphenol
• Canonical SMILES: CCCCCCC1=CC=C(C=C1)O
• InChI Key: SZWBRVPZWJYIHI-UHFFFAOYSA-N
• Boiling Point: 281.2ºC at 760 mmHg
• Melting Point: 32ºC
• Flash Point: 148.1ºC
• Density: 0.954 g/cm³
• EC Number: 219-501-2
• Exact Mass: 178.13600
• Hazard Statements: H315-H319-H413
• H-Bond Acceptor: 1
• H-Bond Donor: 1
• RIDADR: UN3082 - class 9 - PG 3 - DOT NA1993 - Environmentally hazardous substances, liquid, n.o.s. HI: all (not BR)
• Safety Description: S26-S36/37/39-S45
• Symbol: GHS07

Custom Q&A

What is the molecular formula of 4-Hexylphenol?

The molecular formula of 4-Hexylphenol is C12H18O.

What is the molecular weight of 4-Hexylphenol?

The molecular weight of 4-Hexylphenol is 178.27 g/mol.

What is the IUPAC name of 4-Hexylphenol?

The IUPAC name of 4-Hexylphenol is 4-hexylphenol.

What is the InChI of 4-Hexylphenol?

The InChI of 4-Hexylphenol is InChI=1S/C12H18O/c1-2-3-4-5-6-11-7-9-12(13)10-8-11/h7-10,13H,2-6H2,1H3.

What is the InChIKey of 4-Hexylphenol?

The InChIKey of 4-Hexylphenol is SZWBRVPZWJYIHI-UHFFFAOYSA-N.

What is the canonical SMILES of 4-Hexylphenol?

The canonical SMILES of 4-Hexylphenol is CCCCCCC1=CC=C(C=C1)O.

What is the CAS number of 4-Hexylphenol?

The CAS number of 4-Hexylphenol is 2446-69-7.

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

The European Community (EC) number of 4-Hexylphenol is 219-501-2.

What is the UNII of 4-Hexylphenol?

The UNII of 4-Hexylphenol is 3V1KE0N8D5.

Is 4-Hexylphenol a canonicalized compound?

Yes, 4-Hexylphenol is a canonicalized compound.