4-TERT-BUTYL-1-(ETHOXYCARBONYLMETHOXY)THIACALIX[4]ARENE

CAS No.
210706-03-9
CCD No.
CCD00562713
Formula
C56 H72 O12 S4
MolWeight
1065.44

Basic Information

Product Name: 4-TERT-BUTYL-1-(ETHOXYCARBONYLMETHOXY)THIACALIX[4]ARENE
CAS: 210706-03-9
English Synonyms: TETRA-TERT-BUTYL[TETRAKIS(ETHOXYCARBONYLMETHOXY)]TETRATHIACALIX[4]ARENE ; 4-TERT-BUTYL-1-(ETHOXYCARBONYLMETHOXY)THIACALIX[4]ARENE
MDL Number.: MFCD06797059
H bond acceptor: 12
H bond donor: 0
Smile: CCOC(=O)COc1c2cc(cc1sc3cc(cc(c3OCC(=O)OCC)sc4cc(cc(c4OCC(=O)OCC)sc5cc(cc(c5OCC(=O)OCC)s2)C(C)(C)C)C(C)(C)C)C(C)(C)C)C(C)(C)C
InChi: InChI=1S/C56H72O12S4/c1-17-61-45(57)29-65-49-37-21-33(53(5,6)7)22-38(49)70-40-24-35(55(11,12)13)26-42(51(40)67-31-47(59)63-19-3)72-44-28-36(56(14,15)16)27-43(52(44)68-32-48(60)64-20-4)71-41-25-34(54(8,9)10)23-39(69-37)50(41)66-30-46(58)62-18-2/h21-28H,17-20,29-32H2,1-16H3
InChiKey: InChIKey=IGVIIKFHGZNQFL-UHFFFAOYSA-N

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