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B99006

Sigma-Aldrich

2-sec-Butylphenol

98%

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About This Item

Linear Formula:
C2H5CH(CH3)C6H4OH
CAS Number:
89-72-5
Molecular Weight:
150.22
Beilstein:
1210026
EC Number:
201-933-8
MDL number:
MFCD00002225
UNSPSC Code:
12352100
PubChem Substance ID:
24892163
NACRES:
NA.22

vapor pressure

0.03 mmHg ( 20 °C)

Assay

98%

form

liquid

refractive index

n20/D 1.522 (lit.)

bp

226-228 °C (lit.)

mp

12 °C (lit.)

density

0.982 g/mL at 25 °C (lit.)

SMILES string

CCC(C)c1ccccc1O

InChI

1S/C10H14O/c1-3-8(2)9-6-4-5-7-10(9)11/h4-8,11H,3H2,1-2H3

InChI key

NGFPWHGISWUQOI-UHFFFAOYSA-N

Gene Information

rat ... Ar(24208)

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Application

2-sec-Butylphenol is a precursor to synthesize various coumarin and benzofuran derivatives that are used as lipid-lowering agents and potential bone anabolic agents. It can also be used as a solvent in organic synthesis.

Pictograms

CorrosionExclamation mark
GHS05,GHS07

Signal Word

Danger

Hazard Statements

H302,H314

Hazard Classifications

Acute Tox. 4 Oral - Skin Corr. 1C

Storage Class Code

8A - Combustible corrosive hazardous materials

WGK

WGK 2

Flash Point(F)

233.6 °F - closed cup

Flash Point(C)

112 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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Benzofuran-dihydropyridine hybrids: A new class of potential bone anabolic agents.
Modukuri R K, et al.
Bioorganic & Medicinal Chemistry, 25(24), 6450-6466 (2017)
Spectrophotometric determination of nitrate in vegetable products using 2-sec-butylphenol.
A Tanaka et al.
The Analyst, 107(1271), 190-194 (1982-02-01)
Discovery of coumarin?dihydropyridine hybrids as bone anabolic agents.
Sashidhara K V, et al.
Journal of Medicinal Chemistry, 56(1), 109-122 (2012)
Benzofuran-pyran hybrids: A new class of potential bone anabolic agents.
Gupta S, et al.
Bioorganic & Medicinal Chemistry Letters, 28(10), 1719-1724 (2018)
V P Bintoro et al.
The Analyst, 120(11), 2747-2753 (1995-11-01)
A rapid, simple and direct visible spectrophotometric method, based on the quantitative nitration of 2-sec-butylphenol in concentrated sulfuric acid, is described for the determination of nitrate in milk. The nitration product was extracted into toluene and the yellow nitrophenoxide compound
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