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Merck
CN

77612

Phenol

purum, ≥99.0% (GC)

Synonym(s):

Hydroxybenzene

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About This Item

Linear Formula:
C6H5OH
CAS Number:
108-95-2
Molecular Weight:
94.11
EC Number:
203-632-7
UNSPSC Code:
12352100
MDL number:
MFCD00002143
Beilstein/REAXYS Number:
969616

Key Documents

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vapor density

3.24 (vs air)

vapor pressure

0.09 psi ( 55 °C), 0.36 mmHg ( 20 °C)

grade

purum

assay

≥99.0% (GC)

form

liquid

autoignition temp.

1319 °F

expl. lim.

8.6 %

color

faintly yellow

bp

182 °C (lit.)

mp

39-41 °C, 40-42 °C (lit.)

density

1.071 g/mL at 25 °C (lit.)

SMILES string

Oc1ccccc1

InChI

1S/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7H

InChI key

ISWSIDIOOBJBQZ-UHFFFAOYSA-N

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Physical form

cast in container

signalword

Danger

Hazard Classifications

Acute Tox. 3 Dermal - Acute Tox. 3 Inhalation - Acute Tox. 3 Oral - Aquatic Chronic 2 - Eye Dam. 1 - Muta. 2 - Skin Corr. 1B - STOT RE 2

target_organs

Nervous system,Kidney,Liver,Skin

Storage Class

6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials

wgk

WGK 2

flash_point_f

177.8 °F - closed cup

flash_point_c

81 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges

Regulatory Information

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Masaharu Nakamura et al.
Bioorganic & medicinal chemistry, 21(7), 1643-1651 (2013-03-07)
We previously reported that bis-phenol derivatives, including LG190178 (3a), possess not only vitamin D receptor (VDR) agonistic activity, but also androgen receptor (AR) antagonistic activity. Here, we describe the design, synthesis and evaluation of silicon-containing bis-phenol derivatives, with the objective
Britta T Eklund et al.
Marine pollution bulletin, 46(2), 171-181 (2003-02-15)
Toxic effects on macroalgae have been compiled. Eighty-two articles have been found in literature during 1959-2000. A total of 120 substances were investigated using 65 different macroalgae species. About one-third of the tested compounds were organic substances (33%), another third
Rita A Busuttil et al.
Clinical cancer research : an official journal of the American Association for Cancer Research, 20(10), 2761-2772 (2014-03-25)
Gene-expression profiling has revolutionized the way we think about cancer and confers the ability to observe the synchronous expression of thousands of genes. The use of putative genome-level expression profiles has allowed biologists to observe the complex interactions of genes
Serdar Durdagi et al.
Bioorganic & medicinal chemistry, 19(4), 1381-1389 (2011-02-02)
Carbonic anhydrases (CAs, EC 4.2.1.1) are inhibited by sulfonamides, inorganic anions, phenols, coumarins (acting as prodrugs) and polyamines. A novel class of CA inhibitors (CAIs), interacting with the CA isozymes I, II (cytosolic) and IX, XII (transmembrane, tumor-associated) in a
Kyoko Matsumoto et al.
Nucleic acids research, 42(16), e125-e125 (2014-07-19)
To identify and characterize transcript structures ranging from transcriptional start sites (TSSs) to poly(A)-addition sites (PASs), we constructed and analyzed human TSS/PAS mate pair full-length cDNA libraries from 14 tissue types and four cell lines. The collected information enabled us
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