disodium;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-ethylphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;bis(2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-ethyloxane-3,4,5-triol);2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-methyloxane-3,4,5-triol;[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-methylphosphinate;[3-[1-chloro-3'-(2,2,2-trifluoroethoxy)spiro[adamantane-4,4'-dioxetane]-3'-yl]phenoxy]-methylphosphinate

C180H234Cl7F3N2Na2O63P2-2 — CID 163562810

About disodium;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-ethylphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;bis(2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-ethyloxane-3,4,5-triol);2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-methyloxane-3,4,5-triol;[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-methylphosphinate;[3-[1-chloro-3'-(2,2,2-trifluoroethoxy)spiro[adamantane-4,4'-dioxetane]-3'-yl]phenoxy]-methylphosphinate

disodium;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-ethylphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;bis(2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-ethyloxane-3,4,5-triol);2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-methyloxane-3,4,5-triol;[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-methylphosphinate;[3-[1-chloro-3'-(2,2,2-trifluoroethoxy)spiro[adamantane-4,4'-dioxetane]-3'-yl]phenoxy]-methylphosphinate (PubChem CID 163562810) has the molecular formula C180H234Cl7F3N2Na2O63P2-2 and a molecular weight of 3846.90 g/mol. Its IUPAC name is disodium;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-ethylphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;bis(2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-ethyloxane-3,4,5-triol);2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-methyloxane-3,4,5-triol;[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-methylphosphinate;[3-[1-chloro-3'-(2,2,2-trifluoroethoxy)spiro[adamantane-4,4'-dioxetane]-3'-yl]phenoxy]-methylphosphinate.

Molecular Properties

• Compound Name: disodium;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-ethylphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;bis(2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-ethyloxane-3,4,5-triol);2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-methyloxane-3,4,5-triol;[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-methylphosphinate;[3-[1-chloro-3'-(2,2,2-trifluoroethoxy)spiro[adamantane-4,4'-dioxetane]-3'-yl]phenoxy]-methylphosphinate
• PubChem CID: 163562810
• Molecular Formula: C180H234Cl7F3N2Na2O63P2-2
• Molecular Weight: 3846.90 g/mol
• Exact Mass: 3841.22
• IUPAC Name: disodium;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-ethylphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;bis(2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-ethyloxane-3,4,5-triol);2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-methyloxane-3,4,5-triol;[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-methylphosphinate;[3-[1-chloro-3'-(2,2,2-trifluoroethoxy)spiro[adamantane-4,4'-dioxetane]-3'-yl]phenoxy]-methylphosphinate
• SMILES: CCC(O)C(O)C1OC(Oc2cc(C3(OC)OOC34C3CC5CC4CC(Cl)(C5)C3)ccc2OC)(C(=O)[O-])CC(O)C1NC(C)=O.CCC1OC(Oc2cc(C3(OC)OOC34C3CC5CC4CC(Cl)(C5)C3)ccc2OC)C(O)C(O)C1O.CCC1OC(Oc2cc(C3(OC)OOC34C3CC5CC4CC(Cl)(C5)C3)ccc2OC)C(O)C(O)C1O.CCc1ccc(C2(OC)OOC23C2CC4CC3CC(Cl)(C4)C2)cc1OC1(C(=O)[O-])CC(O)C(NC(C)=O)C(C(O)C(O)CC)O1.COc1ccc(C2(OC)OOC23C2CC4CC3CC(Cl)(C4)C2)cc1OC1OC(C)C(O)C(O)C1O.COc1ccc(C2(OC)OOC23C2CC4CC3CC(Cl)(C4)C2)cc1OP(C)(=O)[O-].CP(=O)([O-])Oc1cccc(C2(OCC(F)(F)F)OOC23C2CC4CC3CC(Cl)(C4)C2)c1.[Na+].[Na+]
• InChI: InChI=1S/C32H44ClNO11.C31H42ClNO12.2C26H35ClO9.C25H33ClO9.C20H23ClF3O6P.C20H26ClO7P.2Na/c1-5-18-7-8-19(32(41-4)31(44-45-32)20-9-17-10-21(31)14-29(33,12-17)13-20)11-24(18)42-30(28(39)40)15-23(37)25(34-16(3)35)27(43-30)26(38)22(36)6-2;1-5-20(35)25(37)26-24(33-15(2)34)21(36)14-29(43-26,27(38)39)42-23-10-17(6-7-22(23)40-3)31(41-4)30(44-45-31)18-8-16-9-19(30)13-28(32,11-16)12-18;2*1-4-17-20(28)21(29)22(30)23(33-17)34-19-9-14(5-6-18(19)31-2)26(32-3)25(35-36-26)15-7-13-8-16(25)12-24(27,10-13)11-15;1-12-19(27)20(28)21(29)22(32-12)33-18-8-14(4-5-17(18)30-2)25(31-3)24(34-35-25)15-6-13-7-16(24)11-23(26,9-13)10-15;1-31(25,26)28-16-4-2-3-13(7-16)20(27-11-18(22,23)24)19(29-30-20)14-5-12-6-15(19)10-17(21,8-12)9-14;1-24-16-5-4-13(8-17(16)26-29(3,22)23)20(25-2)19(27-28-20)14-6-12-7-15(19)11-18(21,9-12)10-14;;/h7-8,11,17,20-23,25-27,36-38H,5-6,9-10,12-15H2,1-4H3,(H,34,35)(H,39,40);6-7,10,16,18-21,24-26,35-37H,5,8-9,11-14H2,1-4H3,(H,33,34)(H,38,39);2*5-6,9,13,15-17,20-23,28-30H,4,7-8,10-12H2,1-3H3;4-5,8,12-13,15-16,19-22,27-29H,6-7,9-11H2,1-3H3;2-4,7,12,14-15H,5-6,8-11H2,1H3,(H,25,26);4-5,8,12,14-15H,6-7,9-11H2,1-3H3,(H,22,23);;/q;;;;;;;2*+1/p-4
• InChIKey: FSRSEGJOHXCSIK-UHFFFAOYSA-J
• XLogP: 11.32
• TPSA: 872.91 Ų
• H-Bond Donors: 17
• H-Bond Acceptors: 63
• Rotatable Bonds: 47
• Heavy Atoms: 259
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3846.90
LogP ≤ 5	11.32
H-Bond Donors ≤ 5	17
H-Bond Acceptors ≤ 10	63

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of disodium;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-ethylphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;bis(2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-ethyloxane-3,4,5-triol);2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-methyloxane-3,4,5-triol;[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-methylphosphinate;[3-[1-chloro-3'-(2,2,2-trifluoroethoxy)spiro[adamantane-4,4'-dioxetane]-3'-yl]phenoxy]-methylphosphinate?

The IUPAC name of disodium;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-ethylphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;bis(2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-ethyloxane-3,4,5-triol);2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-methyloxane-3,4,5-triol;[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-methylphosphinate;[3-[1-chloro-3'-(2,2,2-trifluoroethoxy)spiro[adamantane-4,4'-dioxetane]-3'-yl]phenoxy]-methylphosphinate (CID 163562810) is disodium;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-ethylphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;bis(2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-ethyloxane-3,4,5-triol);2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-methyloxane-3,4,5-triol;[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-methylphosphinate;[3-[1-chloro-3'-(2,2,2-trifluoroethoxy)spiro[adamantane-4,4'-dioxetane]-3'-yl]phenoxy]-methylphosphinate.

What is the SMILES notation for disodium;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-ethylphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;bis(2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-ethyloxane-3,4,5-triol);2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-methyloxane-3,4,5-triol;[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-methylphosphinate;[3-[1-chloro-3'-(2,2,2-trifluoroethoxy)spiro[adamantane-4,4'-dioxetane]-3'-yl]phenoxy]-methylphosphinate?

The canonical SMILES for disodium;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-ethylphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;bis(2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-ethyloxane-3,4,5-triol);2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-methyloxane-3,4,5-triol;[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-methylphosphinate;[3-[1-chloro-3'-(2,2,2-trifluoroethoxy)spiro[adamantane-4,4'-dioxetane]-3'-yl]phenoxy]-methylphosphinate is CCC(O)C(O)C1OC(Oc2cc(C3(OC)OOC34C3CC5CC4CC(Cl)(C5)C3)ccc2OC)(C(=O)[O-])CC(O)C1NC(C)=O.CCC1OC(Oc2cc(C3(OC)OOC34C3CC5CC4CC(Cl)(C5)C3)ccc2OC)C(O)C(O)C1O.CCC1OC(Oc2cc(C3(OC)OOC34C3CC5CC4CC(Cl)(C5)C3)ccc2OC)C(O)C(O)C1O.CCc1ccc(C2(OC)OOC23C2CC4CC3CC(Cl)(C4)C2)cc1OC1(C(=O)[O-])CC(O)C(NC(C)=O)C(C(O)C(O)CC)O1.COc1ccc(C2(OC)OOC23C2CC4CC3CC(Cl)(C4)C2)cc1OC1OC(C)C(O)C(O)C1O.COc1ccc(C2(OC)OOC23C2CC4CC3CC(Cl)(C4)C2)cc1OP(C)(=O)[O-].CP(=O)([O-])Oc1cccc(C2(OCC(F)(F)F)OOC23C2CC4CC3CC(Cl)(C4)C2)c1.[Na+].[Na+].

What is the InChIKey of disodium;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-ethylphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;bis(2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-ethyloxane-3,4,5-triol);2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-methyloxane-3,4,5-triol;[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-methylphosphinate;[3-[1-chloro-3'-(2,2,2-trifluoroethoxy)spiro[adamantane-4,4'-dioxetane]-3'-yl]phenoxy]-methylphosphinate?

The InChIKey is FSRSEGJOHXCSIK-UHFFFAOYSA-J. The full InChI is InChI=1S/C32H44ClNO11.C31H42ClNO12.2C26H35ClO9.C25H33ClO9.C20H23ClF3O6P.C20H26ClO7P.2Na/c1-5-18-7-8-19(32(41-4)31(44-45-32)20-9-17-10-21(31)14-29(33,12-17)13-20)11-24(18)42-30(28(39)40)15-23(37)25(34-16(3)35)27(43-30)26(38)22(36)6-2;1-5-20(35)25(37)26-24(33-15(2)34)21(36)14-29(43-26,27(38)39)42-23-10-17(6-7-22(23)40-3)31(41-4)30(44-45-31)18-8-16-9-19(30)13-28(32,11-16)12-18;2*1-4-17-20(28)21(29)22(30)23(33-17)34-19-9-14(5-6-18(19)31-2)26(32-3)25(35-36-26)15-7-13-8-16(25)12-24(27,10-13)11-15;1-12-19(27)20(28)21(29)22(32-12)33-18-8-14(4-5-17(18)30-2)25(31-3)24(34-35-25)15-6-13-7-16(24)11-23(26,9-13)10-15;1-31(25,26)28-16-4-2-3-13(7-16)20(27-11-18(22,23)24)19(29-30-20)14-5-12-6-15(19)10-17(21,8-12)9-14;1-24-16-5-4-13(8-17(16)26-29(3,22)23)20(25-2)19(27-28-20)14-6-12-7-15(19)11-18(21,9-12)10-14;;/h7-8,11,17,20-23,25-27,36-38H,5-6,9-10,12-15H2,1-4H3,(H,34,35)(H,39,40);6-7,10,16,18-21,24-26,35-37H,5,8-9,11-14H2,1-4H3,(H,33,34)(H,38,39);2*5-6,9,13,15-17,20-23,28-30H,4,7-8,10-12H2,1-3H3;4-5,8,12-13,15-16,19-22,27-29H,6-7,9-11H2,1-3H3;2-4,7,12,14-15H,5-6,8-11H2,1H3,(H,25,26);4-5,8,12,14-15H,6-7,9-11H2,1-3H3,(H,22,23);;/q;;;;;;;2*+1/p-4.

What are the key properties of disodium;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-ethylphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;bis(2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-ethyloxane-3,4,5-triol);2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-methyloxane-3,4,5-triol;[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-methylphosphinate;[3-[1-chloro-3'-(2,2,2-trifluoroethoxy)spiro[adamantane-4,4'-dioxetane]-3'-yl]phenoxy]-methylphosphinate?

disodium;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-ethylphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;bis(2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-ethyloxane-3,4,5-triol);2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-methyloxane-3,4,5-triol;[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-methylphosphinate;[3-[1-chloro-3'-(2,2,2-trifluoroethoxy)spiro[adamantane-4,4'-dioxetane]-3'-yl]phenoxy]-methylphosphinate has a molecular weight of 3846.90 g/mol, XLogP of 11.32, 47 rotatable bonds, 17 hydrogen bond donors, and 63 hydrogen bond acceptors.

Where does this data come from?

All data for disodium;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-ethylphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;5-acetamido-2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-(1,2-dihydroxybutyl)-4-hydroxyoxane-2-carboxylate;bis(2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-ethyloxane-3,4,5-triol);2-[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-6-methyloxane-3,4,5-triol;[5-(1-chloro-3'-methoxyspiro[adamantane-4,4'-dioxetane]-3'-yl)-2-methoxyphenoxy]-methylphosphinate;[3-[1-chloro-3'-(2,2,2-trifluoroethoxy)spiro[adamantane-4,4'-dioxetane]-3'-yl]phenoxy]-methylphosphinate is sourced from PubChem (CID 163562810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).