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Safety Information

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

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

PDSCL

Deleterious substance

FSL

Group 4: Flammable liquids
Type 3 petroleums
Hazardous rank III
Water insoluble liquid

ISHL Indicated Name

Substances Subject to be Indicated Names

ISHL Notified Names

Substances Subject to be Notified Names

JAN Code

B99006-VAR:
B99006-100G:4548173955216
B99006-BULK:
B99006-500G:4548173955223

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Certificates of Analysis (COA)

Lot/Batch Number
MKCB1786V
MKBX9303V
MKBX3850V
02806KP
08627LA

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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)
RuSn bimetallic catalysts for selective hydrogenation of levulinic acid to ?-valerolactone.
Wettstein S G, et al.
Applied Catalysis. B, Environmental, 117, 321-329 (2012)
Masashi Hattori et al.
Physical chemistry chemical physics : PCCP, 19(5), 3688-3693 (2017-01-18)
Photo-assisted phosphorylation of an anatase TiO
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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