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Merck
CN

B99006

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
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
24892163
EC Number:
201-933-8
Beilstein/REAXYS Number:
1210026
MDL number:
MFCD00002225

Key Documents

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Product Name

2-sec-Butylphenol, 98%

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

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.)

Quality Level

100

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

signalword

Danger

hcodes

H302,H314

Hazard Classifications

Acute Tox. 4 Oral - Skin Corr. 1C

Storage Class

8A - Combustible corrosive hazardous materials

wgk

WGK 2

flash_point_f

233.6 °F - closed cup

flash_point_c

112 °C - closed cup

ppe

Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
MKCB1786V
MKBX9303V
MKBX3850V
02806KP
08627LA

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Masashi Hattori et al.
Physical chemistry chemical physics : PCCP, 19(5), 3688-3693 (2017-01-18)
Photo-assisted phosphorylation of an anatase TiO
RuSn bimetallic catalysts for selective hydrogenation of levulinic acid to ?-valerolactone.
Wettstein S G, et al.
Applied Catalysis. B, Environmental, 117, 321-329 (2012)
Discovery of coumarin?dihydropyridine hybrids as bone anabolic agents.
Sashidhara K V, et al.
Journal of Medicinal Chemistry, 56(1), 109-122 (2012)
Spectrophotometric determination of nitrate in vegetable products using 2-sec-butylphenol.
A Tanaka et al.
The Analyst, 107(1271), 190-194 (1982-02-01)
Benzofuran-dihydropyridine hybrids: A new class of potential bone anabolic agents.
Modukuri R K, et al.
Bioorganic & Medicinal Chemistry, 25(24), 6450-6466 (2017)
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