3751-96-0 ((7-(bromomethyl)-1,7-dimethylbicyclo[2.2.1]heptan-2-one)

快速询单

结构式：

7-(bromomethyl)-1,7-dimethylbicyclo[2.2.1]heptan-2-oneMOL文件

CAS号：

3751-96-0

英文名称：

7-(bromomethyl)-1,7-dimethylbicyclo[2.2.1]heptan-2-one

分子式：

C₁₀H₁₅BrO

分子量：

231.129502534866

7-(bromomethyl)-1,7-dimethylbicyclo[2.2.1]heptan-2-one(3751-96-0)名称与标识符

名称

英文别名：

7-(bromomethyl)-1,7-dimethylbicyclo[2.2.1]heptan-2-one;8-bromonorbornan-2-one;AKOS016039163;(+)-8-bromocamphor;STK955134;AKOS000267777;Bicyclo[2.2.1]heptan-2-one, 7-(bromomethyl)-1,7-dimethyl-, anti-;(+)-9-bromocamphor;CS-0282979;EN300-297453;F0848-0094;(1S,4R,7R)-7-(bromomethyl)-1,7-dimethylbicyclo[2.2.1]heptan-2-one;7-(Bromomethyl)-1,7-dimethylbicyclo[2.2.1]heptan-2-one #;SCHEMBL5936368;3751-96-0;

标识符

MDL：

MFCD00829082

InChIKey：

JOXACTPHKLKJNP-UHFFFAOYSA-N

Inchi：

1S/C10H15BrO/c1-9-4-3-7(5-8(9)12)10(9,2)6-11/h7H,3-6H2,1-2H3

SMILES：

BrCC1(C)C2CC(C1(C)CC2)=O

7-(bromomethyl)-1,7-dimethylbicyclo[2.2.1]heptan-2-one(3751-96-0)物化性质

实验特性

PSA : 17.07

计算特性

精确分子量 : 230.03065
氢键供体数量 : 0
氢键受体数量 : 1
可旋转化学键数量 : 1
同位素质量 : 230.03063g/mol
重原子数量 : 12
复杂度 : 238
同位素原子数量 : 0
确定原子立构中心数量 : 0
不确定原子立构中心数量 : 3
确定化学键立构中心数量 : 0
不确定化学键立构中心数量 : 0
共价键单元数量 : 1
疏水参数计算参考值（XlogP） : 2.4
拓扑分子极性表面积 : 17.1Å²

7-(bromomethyl)-1,7-dimethylbicyclo[2.2.1]heptan-2-one(3751-96-0)相关文献

1. Further observations on the bromination of camphor
Paul Cachia,Nicholas Darby,Charles R. Eck,Thomas Money J. Chem. Soc. Perkin Trans. 1 1976 359
2. Camphor: a chiral starting material in natural product synthesis
T. Money Nat. Prod. Rep. 1985 2 253
3. A new regiospecific synthesis of 8-bromocamphor
Charles R. Eck,Roy W. Mills,Thomas Money J. Chem. Soc. Perkin Trans. 1 1975 251
4. Synthesis and absolute configuration of the terpenes (–)-campherenone,(+)-epicampherenone, (–)-β-santalene, and (+)-epi-β-santalene
Gordon L. Hodgson,David F. MacSweeney,Roy W. Mills,Thomas Money J. Chem. Soc. Chem. Commun. 1973 235
5. A stereospecific synthetic route to campherenone, campherenol, epicampherenone, β-santalene, epi-β-santalene, ylangocamphor, copacamphor, sativene, and copacamphene
Charles R. Eck,Gordon L. Hodgson,David F. MacSweeney,Roy W. Mills,Thomas Money J. Chem. Soc. Perkin Trans. 1 1974 1938
6. Monoterpenoids
David H. Grayson Nat. Prod. Rep. 2000 17 385
7. Mechanism of C(8)-bromination of 3,3-dibromocamphor
William M. Dadson,Thomas Money J. Chem. Soc. Chem. Commun. 1982 112
8. Organic chemistry
J. Chem. Soc. Abstr. 1925 128 i349
9. Recent progress in the chemistry of indole alkaloids and mould metabolites
J. E. Saxton Nat. Prod. Rep. 1994 11 493
10. Absorption spectra of ketones. Part VIII. The circular dichroism of some trimethylbicyclo[2,2,1]heptan-2-ones
D. E. Bays,G. W. Cannon,R. C. Cookson J. Chem. Soc. B 1966 885

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