4-Hexylphenol

CAS
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Purity
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CAS
2446-69-7
Size
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Purity
>98.0%(GC)
Price
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Availability
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Quantity
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Catalog Number

ACM2446697

Product Name

4-Hexylphenol

Structure

Structure

CAS

2446-69-7

Category

Arenes

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

Molecular Weight

178.27

Molecular Formula

C₈H₁₆ClN

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

MSDS

COA

Spec Sheet

Download Spec Sheet

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.

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