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名称

硼酸及其衍生物

别名

4,4,5,5-四甲基-2-(1,1':4',1''-三联苯)-3-基-1,3,2-二氧杂环戊硼烷 | (1,1':4',1''-三联苯)-3-基硼酸频哪醇酯

英文别名

4,4,5,5-Tetramethyl-2-(1,1':4',1''-terphenyl)-3-yl-1,3,2-dioxaborolane | (1,1':4',1''-Terphenyl)-3-ylboronic Acid Pinacol Ester

英文名称

2-([1,1':4',1''-Terphenyl]-3-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

货号

T405591-1g

包装规格

浓度

≥98%

CAS号

1401577-23-8

分子式

C24H25BO2

分子量

356.27 g/mol

EC号

PubChem SID: 488201888

PubChem编号

57864957

Isomeric SMILES

B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC=C2)C3=CC=C(C=C3)C4=CC=CC=C4

IIUPAC Name

4,4,5,5-tetramethyl-2-[3-(4-phenylphenyl)phenyl]-1,3,2-dioxaborolane

INCHI

1S/C24H25BO2/c1-23(2)24(3,4)27-25(26-23)22-12-8-11-21(17-22)20-15-13-19(14-16-20)18-9-6-5-7-10-18/h5-17H,1-4H3

InChi Key

NVGRDODNVUQSKP-UHFFFAOYSA-N

Smiles

B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC=C2)C3=CC=C(C=C3)C4=CC=CC=C4

PubChem CID

57864957

PubChem SID

488201888

溶解性

可溶于四氢呋喃

熔点

157 °C

氢键供体数Hydrogen Bond Donor Count

氢键受体数Hydrogen Bond Acceptor Count

可旋转键计数Rotatable Bond Count

精确质量Exact Mass

356.195 Da

单同位素质量Monoisotopic Mass

356.195 Da

拓扑极表面积Topological Polar Surface Area

18.500 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

473

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

Reaxy-Rn

29063810

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

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「No related articles yet」

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