The crystal structure of tert-butyl coumarin-3-carboxylate

被引：0
|
作者：
I. Yavari
H. Djahaniani
F. Nasiri
机构：
[1] Tarbiat Modarres University,Department of Chemistry
来源：
Journal of the Iranian Chemical Society | 2006年 / 3卷
关键词：
Coumarin; X-ray structure; Single crystal; Hydrogen bond;
D O I：
暂无
中图分类号：
学科分类号：
摘要：
The crystal structure of tert-butyl coumarin-3-carboxylate has been determined. This compound crystallizes in the triclinic space group P-1 with cell parameters a = 5.8038(9) Å, b = 9.3022(16) Å, c = 12.421(2) Å, β = 97.107(5)°, V = 610.71(17) Å3, Dcalc = 1.339 mg m−3, and Z = 2. The final R value is 0.0593 for 2396 reflections. The adjacent molecules form a cyclic dimer by intermolecular hydrogen bonds of type C=O...H with their carbonyl group and the hydrogen on C(3).
引用
收藏
页码：46 / 50
页数：4
相关论文
共 50 条
  • [31] tert-Butyl 4-carbamoyl-3-methoxyimino-4-methylpiperidine-1-carboxylate
    Wang, Juxian
    Liu, Mingliang
    Cao, Jue
    Wang, Yucheng
    ACTA CRYSTALLOGRAPHICA SECTION E-STRUCTURE REPORTS ONLINE, 2008, 64 : O2294 - U1911
  • [32] CARBENES .28. TERT-BUTYL 2,3,4-TRI-TERT-BUTYLCYCLOBUTADIENE-1-CARBOXYLATE
    EISENBARTH, P
    REGITZ, M
    CHEMISCHE BERICHTE-RECUEIL, 1982, 115 (12): : 3796 - 3810
  • [33] SYNTHESIS OF TERT-BUTYL 3-OXOALKANOATES BY ACYLATION OF TERT-BUTYL LITHIOACETATE WITH ALKYL CARBOXYLATES
    OHTA, S
    SHIMABAYASHI, A
    HAYAKAWA, S
    SUMINO, M
    OKAMOTO, M
    SYNTHESIS-STUTTGART, 1985, (01): : 45 - 48
  • [34] Tert-Butyl 3-phenylcarbazate
    Zhou, Bin
    Gao, Wen-Yuan
    Zhang, Tie-Jun
    Zhang, Jia-Xin
    ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, 2006, 62 : O5393 - O5394
  • [35] tert-butyl 2-(dihydroxyboryl)pyrrole-1-carboxylate
    Klis, Tomasz
    Serwatowski, Janusz
    ACTA CRYSTALLOGRAPHICA SECTION E-STRUCTURE REPORTS ONLINE, 2008, 64 : O1054 - U1968
  • [36] CRYSTAL AND MOLECULAR-STRUCTURE OF (3-[TERT-BUTYL(PHENYL)PHOSPHINO]PROPYL)DIMETHYLTIN CHLORIDE
    WEICHMANN, H
    MEUNIERPIRET, J
    VANMEERSSCHE, M
    JOURNAL OF ORGANOMETALLIC CHEMISTRY, 1986, 309 (03) : 267 - 272
  • [37] Synthesis and stereoisomerism of derivatives of tert-butyl 7-alkylideneceph-3-em-4-carboxylate
    Vorona, M.
    Veinberg, G.
    Belyakov, S.
    Petrova, M.
    Liepinsh, E.
    Lukevics, E.
    CHEMISTRY OF HETEROCYCLIC COMPOUNDS, 2008, 44 (04) : 486 - 493
  • [38] Crystal structure of tert-butyl(phenylsulfinyl) carbamate, C11H15NO3S
    Makam, Parameshwar
    Samipillai, Marivel
    Kruger, Hendrick G.
    Govender, Thavendran
    Naicker, Tricia
    ZEITSCHRIFT FUR KRISTALLOGRAPHIE-NEW CRYSTAL STRUCTURES, 2017, 232 (04): : 577 - 578
  • [39] Dimeric di(tert-butyl)haloalanes and a monomeric di(tert-butyl)phosphino-di(tert-butyl)alane
    Krossing, Ingo
    Noeth, Heinrich
    Staude, Siegfried
    ZEITSCHRIFT FUR NATURFORSCHUNG SECTION B-A JOURNAL OF CHEMICAL SCIENCES, 2008, 63 (09): : 1045 - 1051
  • [40] Stereoselective syntheses of substituted tert-butyl 3-allyl-4-hydroxypiperidine-1-carboxylate
    Boev, V. I.
    Moskalenko, A. I.
    Belopukhov, S. L.
    Przheval'skii, N. M.
    RUSSIAN JOURNAL OF ORGANIC CHEMISTRY, 2015, 51 (04) : 493 - 497
12345