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Merck
CN

B11907

Sigma-Aldrich

1-苯基-1,3-丁二酮

99%

别名:

苯甲酰丙酮

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About This Item

线性分子式:
C6H5COCH2COCH3
CAS号:
分子量:
162.19
Beilstein:
742413
EC 号:
MDL编号:
UNSPSC代码:
12352100
PubChem化学物质编号:
NACRES:
NA.22

质量水平

方案

99%

表单

powder

mp

54-56 °C (lit.)

密度

1.09 g/mL at 25 °C (lit.)

SMILES字符串

CC(=O)CC(=O)c1ccccc1

InChI

1S/C10H10O2/c1-8(11)7-10(12)9-5-3-2-4-6-9/h2-6H,7H2,1H3

InChI key

CVBUKMMMRLOKQR-UHFFFAOYSA-N

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储存分类代码

11 - Combustible Solids

WGK

WGK 3

闪点(°F)

Not applicable

闪点(°C)

Not applicable

个人防护装备

Eyeshields, Gloves, type N95 (US)

法规信息

新产品

历史批次信息供参考:

分析证书(COA)

Lot/Batch Number

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Arpad Mihai Rostas et al.
Molecules (Basel, Switzerland), 25(17) (2020-08-23)
Complexes with mixed ligands [Cu(N-N)2(pmtp)](ClO4)2 ((1) N-N: 2,2'-bipyridine; (2) L: 1,10-phenanthroline and pmpt: 5-phenyl-7-methyl-1,2,4-triazolo[1,5-a]pyrimidine) were synthesized and structurally and biologically characterized. Compound (1) crystallizes into space group Pa and (2) in P-1. Both complexes display an intermediate stereochemistry between the
Yasuko Yamada Maruo et al.
Analytica chimica acta, 702(2), 247-253 (2011-08-16)
We have developed a portable device for formaldehyde monitoring with both high sensitivity and high temporal resolution, and carried out indoor air formaldehyde concentration analysis. The absorbance difference of the sensor element was measured in the monitoring device at regular
Sayyed Faramarz Tayyari et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 66(3), 626-636 (2006-07-25)
Molecular structure and vibrational frequencies of 4,4,4-trifluoro-1-phenyl-1,3-butanedione, known as trifluorobenzoylacetone (TFBA), have been investigated by means of density functional theory (DFT) calculations. The results were compared with those of benzoylacetone (BA), acetylacetone (AA), and trifluoroacetylacetone (TFAA). Comparing the calculated and
B Schiøtt et al.
Proceedings of the National Academy of Sciences of the United States of America, 95(22), 12799-12802 (1998-10-28)
The electronic nature of low-barrier hydrogen bonds (LBHBs) in enzymatic reactions is discussed based on combined low temperature neutron and x-ray diffraction experiments and on high level ab initio calculations by using the model substrate benzoylacetone. This molecule has a
Ahmed A Soliman et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 65(3-4), 841-845 (2006-04-01)
Reactions of M(CO)(6), where M=Cr and Mo with Schiff bases prepared by the condensation of ethanolamine with either acetylacetone or benzoylacetone were investigated. The reactions of Cr(CO)(6) in benzene resulted in the formation of the tricarbonyl drivatives [Cr(CO)(3)(HL)], HL=acaceaH or

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