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Merck
CN

736171

Supelco

1,4-Dioxane solution

suitable for NMR (reference standard), 40% in benzene-d6 (99.6 atom % D), NMR tube size 5 mm × 8 in.

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About This Item

Empirical Formula (Hill Notation):
C4H8O2
CAS Number:
123-91-1
Molecular Weight:
88.11
MDL number:
MFCD00006571
UNSPSC Code:
12142201
PubChem Substance ID:
329765091
NACRES:
NA.24

Key Documents

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grade

analytical standard

Quality Level

200

concentration

40% in benzene-d6 (99.6 atom % D)

technique(s)

NMR: suitable

NMR tube size

5 mm × 8 in.

NMR tube wall thickness

0.24 mm , ultra-thin wall

suitability

suitable for NMR (reference standard)

format

single component solution

SMILES string

C1COCCO1

InChI

1S/C4H8O2/c1-2-6-4-3-5-1/h1-4H2

InChI key

RYHBNJHYFVUHQT-UHFFFAOYSA-N

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General description

This compound is listed in the SVHC (Substances of very high concern) candidate list of ECHA (European Chemicals Agency)

Features and Benefits

13C sensitivity

Preparation Note

5 mm O.D. tube contains 0.700 mL.

Signal Word

Danger

Hazard Classifications

Aquatic Chronic 3 - Asp. Tox. 1 - Carc. 1A - Eye Irrit. 2 - Flam. Liq. 2 - Muta. 1B - Skin Irrit. 2 - STOT RE 1 - STOT SE 3

Target Organs

Blood, Respiratory system

Supplementary Hazards

EUH019

Storage Class Code

3 - Flammable liquids

WGK

WGK 3

Flash Point(F)

53.6 °F - closed cup

Flash Point(C)

12 °C - closed cup

Regulatory Information

危险化学品

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Certificates of Analysis (COA)

Lot/Batch Number
MBBD5764
MBBD5382
MBBC6298
MBBC3428
MBBB8950V

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Daniel Gerrity et al.
Water research, 46(19), 6257-6272 (2012-10-16)
The performance of ozonation in wastewater depends on water quality and the ability to form hydroxyl radicals (·OH) to meet disinfection or contaminant transformation objectives. Since there are no on-line methods to assess ozone and ·OH exposure in wastewater, many
Abdullah M Asiri et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 95, 679-684 (2012-05-18)
The absorption and fluorescence characteristics of 4-(p-N,N-dimethyl-aminophenylmethylene)-2-phenyl-5-oxazolone (DPO) have been investigated in different solvents. DPO dye exhibits a large red shift in both absorption and emission spectra as solvent polarity increases, indicating a large change in the dipole moment of
Iñaki Galve et al.
Molecular diversity, 16(4), 639-649 (2012-10-12)
A practical protocol was developed for the synthesis of 2-arylamino substituted 4-amino-5,6-dihydropyrido[2,3-d]pyrimidin-7(8H)-ones from α,β-unsaturated esters, malononitrile, and an aryl substituted guanidine via the corresponding 3-aryl-3,4,5,6- tetrahydropyrido[2,3-d]pyrimidin-7(8H)-ones. Such compounds are formed upon treatment of 2-methoxy-6-oxo-1,4,5,6-tetrahydropyridine-3-carbonitriles with an aryl substituted guanidine in
Sobhi M Gomha et al.
Molecules (Basel, Switzerland), 17(8), 9335-9347 (2012-08-07)
Successful implementation of ultrasound irradiation for the rapid synthesis of a novel series of 3-[1-(4-substituted-5-(aryldiazenyl)thiazol-2-yl)hydrazono)ethyl]-2H-chromen-2-ones 5a-h, via reactions of 2-(1-(2-oxo-2H-chromen-3-yl)ethylidene) thiosemicarbazide (2) and the hydrazonoyl halides 3(4), was demonstrated. Also, a new series of 5-arylidene-2-(2-(1-(2-oxo-2H-chromen-3-yl)ethylidene)hydrazinyl)thiazol-4(5H)-ones 10a-d were synthesized from reaction
B Thanuja et al.
Ultrasonics sonochemistry, 19(6), 1213-1220 (2012-04-14)
Density (ρ), ultrasonic velocity (U), for the binary mixtures of 4-methoxy benzoin (4MB) with ethanol, chloroform, acetonitrile, benzene, and di-oxane were measured at 298K. The solute-solvent interactions and the effect of the polarity of the solvent on the type of
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