2,4-Di-Tert-Butylphenol - Materials / Alfa Chemistry

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2,4-Di-Tert-Butylphenol

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Catalog Number

ACMA00017281

Product Name

2,4-Di-Tert-Butylphenol

Category

Polymers

Description

Liquid

IUPAC Name

2,4-ditert-butylphenol

Molecular Weight

206.32g/mol

Molecular Formula

C14H22O

Canonical SMILES

CC(C)(C)C1=CC(=C(C=C1)O)C(C)(C)C

InChI

InChI=1S/C14H22O/c1-13(2,3)10-7-8-12(15)11(9-10)14(4,5)6/h7-9,15H,1-6H3

InChI Key

ICKWICRCANNIBI-UHFFFAOYSA-N

Boiling Point

263.5 °C;263.5 °C

Melting Point

56.5 °C;56.5 °C

Solubility

1.70e-04 M;In water, 35 mg/L at 25 °C;Slightly soluble in carbon tetrachloride; insoluble in alkali

Color/Form

White to yellow powder or solid

Complexity

206

Covalently-Bonded Unit Count

EC Number

202-532-0

Exact Mass

206.167065g/mol

Formal Charge

Heavy Atom Count

Log P

5.19 (LogP);log Kow = 5.19

MeSH Entry Terms

2,4-bis(tert-butyl)phenol;2,4-di-t-butylphenol;2,4-di-tert-butylphenol;2,4-DTBP

Monoisotopic Mass

206.167065g/mol

NSC Number

174502

Other Experimental

Henry's Law constant = 3.7X10-5 atm-cu m/mol at 25 °C (est);Hydroxyl radical reaction rate constant = 4.91X10-11 cu cm/molec-sec at 25 °C (est)

Refractive Index

Index of refraction: 1.5080 at 20 °C/D

Rotatable Bond Count

RTECS Number

SK8260000

Stability

Stable under recommended storage conditions.

UNII

FOB94G6HZT

Vapor Pressure

0.00 mmHg;4.77X10-3 mm Hg at 24 °C (extrapolated)

XLogP3

4.9

MSDS

Download MSDS

COA

Download COA

Spec Sheet

Download Spec Sheet

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