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Merck
CN

05-7200

Cyclohexanone

SAJ first grade, ≥98.0%

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About This Item

Linear Formula:
C6H10(=O)
CAS Number:
Molecular Weight:
98.14
EC Number:
203-631-1
UNSPSC Code:
12352100
PubChem Substance ID:
Beilstein/REAXYS Number:
385735
MDL number:
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InChI key

JHIVVAPYMSGYDF-UHFFFAOYSA-N

InChI

1S/C6H10O/c7-6-4-2-1-3-5-6/h1-5H2

SMILES string

O=C1CCCCC1

grade

SAJ first grade

vapor density

3.4 (vs air)

vapor pressure

3.4 mmHg ( 20 °C)

assay

≥98.0%

form

liquid

autoignition temp.

788 °F

expl. lim.

1.1 %, 100 °F, 9.4 %

availability

available only in Japan

bp

155 °C (lit.)

mp

−47 °C (lit.)

density

0.947 g/mL at 25 °C (lit.)

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signalword

Danger

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Dam. 1 - Flam. Liq. 3 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

3 - Flammable liquids

wgk

WGK 1

flash_point_f

111.2 °F - closed cup

flash_point_c

44 °C - closed cup

ppe

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

Regulatory Information

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Won-Heong Lee et al.
Applied microbiology and biotechnology, 97(4), 1561-1569 (2012-10-12)
Sufficient supply of NADPH is one of the most important factors affecting the productivity of biotransformation processes. In this study, construction of an efficient NADPH-regenerating system was attempted using direct phosphorylation of NADH by NADH kinase (Pos5p) from Saccharomyces cerevisiae
Viktória Fábos et al.
Chemistry, an Asian journal, 7(11), 2638-2643 (2012-09-07)
The processing of renewable feedstocks to platform chemicals and, to a lesser degree, fuels is a key part of sustainable development. In particular, the combination of lignocellulosic biomass with hydrothermal upgrading (HTU), using high temperature and pressure water (HTPW), is
Yun-Yun Xu et al.
Bioorganic & medicinal chemistry, 21(2), 388-394 (2012-12-19)
A type of novel α,β-unsaturated cyclohexanone analogous, which designed based on the curcumin core structure, have been discovered as potential EGFR inhibitors. These compounds exhibit potent antiproliferative activity in two human tumor cell lines (Hep G2 and B16-F10). Among them
M Zheng et al.
Xenobiotica; the fate of foreign compounds in biological systems, 32(5), 427-439 (2002-06-18)
1. Hydromorphone-3-glucuronide, dihydromorphine, dihydroisomorphine, dihydromorphine-3-glucuronide and dihydroisomorphine-3-glucuronide were isolated from a cancer patient's urine and identified as metabolites of hydromorphone by comparison with synthetic standards using LC/MS/MS with gradient elution. 2. The relative urinary recovery of dihydroisomorphine-3-glucuronide was estimated to
Application of fragment screening and merging to the discovery of inhibitors of the Mycobacterium tuberculosis cytochrome P450 CYP121.
Sean A Hudson et al.
Angewandte Chemie (International ed. in English), 51(37), 9311-9316 (2012-08-15)

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