142719
苯甲酸苯酯
99%
别名:
安息香酸苯酯
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线性分子式:
C6H5CO2C6H5
化学文摘社编号:
分子量:
198.22
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
202-293-2
Beilstein/REAXYS Number:
1566346
MDL number:
产品名称
苯甲酸苯酯, 99%
InChI key
FCJSHPDYVMKCHI-UHFFFAOYSA-N
InChI
1S/C13H10O2/c14-13(11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h1-10H
SMILES string
O=C(Oc1ccccc1)c2ccccc2
assay
99%
form
solid
bp
298-299 °C (lit.)
mp
68-70 °C (lit.)
solubility
alcohol: freely soluble (hot)
diethyl ether: slightly soluble
water: insoluble
functional group
ester
phenoxy
phenyl
Quality Level
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Application
苯甲酸苯酯曾被用于以二酸酐/二胺衍生物合成可溶性聚酰亚胺的过程 。
General description
苯甲酸苯酯是苯甲酸的苯基酯。苯甲酸苯酯的晶体结构已由844微密度计测量的强度确定。据报告，所有键长和键角均正常。苯甲酸苯酯在杂多酸催化下通过Fries重排反应生成酰化苯酚和酯。
苯甲酸苯酯作为前体，通过分子内芳基-芳基偶联反应产生用于合成(−)五加酮的中间体。
苯甲酸苯酯作为前体，通过分子内芳基-芳基偶联反应产生用于合成(−)五加酮的中间体。
signalword
Warning
hcodes
Hazard Classifications
Acute Tox. 4 Oral - Skin Irrit. 2
存储类别
11 - Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
Intramolecular biaryl coupling reaction of benzyl benzoate and phenyl benzoate derivatives, and its application to the formal synthesis of (-)-steganon
Takeda S, et al.
Tetrahedron, 63, 396-408 (2007)
Daun Jung et al.
Journal of applied toxicology : JAT, 36(9), 1129-1136 (2015-12-23)
In vitro testing methods for classifying sensitizers could be valuable alternatives to in vivo sensitization testing using animal models, such as the murine local lymph node assay (LLNA) and the guinea pig maximization test (GMT), but there remains a need
SYNTHESIS OF SOLUBLE HIGH Tg POLYIMIDES UTILIZING ESTER-ACID DIANHYDRIDE DERIVATIVES.
Moy TM, et al.
Advances in Polyimide Science and Technology: Proceedings of the Fourth International Conference on Polyimides (1993)
Fries rearrangement of aryl esters catalysed by heteropoly acid.
Kozhevnikova EF, et al.
Applied Catalysis A: General, 245(1), 69-78 (2003)
The crystal structure of phenyl benzoate.
Adams JM and Morsi SE.
Acta Crystallographica Section B, Structural Crystallography and Crystal Chemistry, 32(5), 1345-1347 (1976)
商品
Quantum dots (QDs): Semiconductor nanoparticles with diverse applications including displays, lighting, and biomedical imaging.
Fries重排反应是一类重要的有机人名反应，它涉及在催化剂存在下加热时将酚酯转化成邻位或对位酰基酚。
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