4-SULFONIC CALIX[4]ARENE HYDRATE

CAS号
CCD编号
CCD02956731
分子式
C28 H24 O16 S4 . H2 O
分子量
762.76

基本信息

产品名称: 4-SULFONIC CALIX[4]ARENE HYDRATE
英文同义词: 4-SULFONIC CALIX[4]ARENE HYDRATE
MDL号: MFCD16495912
氢键受体数量: 16
氢键供体数量: 8
Smile: c1c(cc2c(c1Cc3cc(cc(c3O)Cc4cc(cc(c4O)Cc5cc(cc(c5O)C2)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)O)S(=O)(=O)O.O
InChi: InChI=1S/C28H24O16S4.H2O/c29-25-13-1-14-6-22(46(36,37)38)8-16(26(14)30)3-18-10-24(48(42,43)44)12-20(28(18)32)4-19-11-23(47(39,40)41)9-17(27(19)31)2-15(25)7-21(5-13)45(33,34)35;/h5-12,29-32H,1-4H2,(H,33,34,35)(H,36,37,38)(H,39,40,41)(H,42,43,44);1H2
InChiKey: InChIKey=RKPGNZQZXOAHMS-UHFFFAOYSA-N

性质

注解: HAZARD: S24/25

安全信息

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