1-cyclohexyl-4-phenoxysulfinylsulfonylbenzene;cyclohexylsulfonylsulfinyloxycyclohexane;(1,3-dioxoisoindol-2-yl) (4-methoxynaphthalen-1-yl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methoxyphenyl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methylphenyl) sulfite;(1,3-dioxoisoindol-2-yl) naphthalen-1-yl sulfite;(1,3-dioxoisoindol-2-yl) phenyl sulfite;(1,3-dioxoisoindol-2-yl) [4-(trifluoromethyl)phenyl] sulfite;molecular hydrogen;1,2,3,4,5-pentafluoro-6-(2,3,4,5,6-pentafluorophenyl)sulfonylsulfinyloxybenzene;1-phenoxysulfinylsulfonyl-4-propan-2-ylbenzene

C153H127F13N6O48S14 — CID 158137996

IUPAC1-cyclohexyl-4-phenoxysulfinylsulfonylbenzene;cyclohexylsulfonylsulfinyloxycyclohexane;(1,3-dioxoisoindol-2-yl) (4-methoxynaphthalen-1-yl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methoxyphenyl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methylphenyl) sulfite;(1,3-dioxoisoindol-2-yl) naphthalen-1-yl sulfite;(1,3-dioxoisoindol-2-yl) phenyl sulfite;(1,3-dioxoisoindol-2-yl) [4-(trifluoromethyl)phenyl] sulfite;molecular hydrogen;1,2,3,4,5-pentafluoro-6-(2,3,4,5,6-pentafluorophenyl)sulfonylsulfinyloxybenzene;1-phenoxysulfinylsulfonyl-4-propan-2-ylbenzene
SMILESCC(C)c1ccc(S(=O)(=O)S(=O)Oc2ccccc2)cc1.COc1ccc(OS(=O)ON2C(=O)c3ccccc3C2=O)c2ccccc12.COc1ccc(OS(=O)ON2C(=O)c3ccccc3C2=O)cc1.Cc1ccc(OS(=O)ON2C(=O)c3ccccc3C2=O)cc1.O=C1c2ccccc2C(=O)N1OS(=O)Oc1ccc(C(F)(F)F)cc1.O=C1c2ccccc2C(=O)N1OS(=O)Oc1cccc2ccccc12.O=C1c2ccccc2C(=O)N1OS(=O)Oc1ccccc1.O=S(OC1CCCCC1)S(=O)(=O)C1CCCCC1.O=S(Oc1c(F)c(F)c(F)c(F)c1F)S(=O)(=O)c1c(F)c(F)c(F)c(F)c1F.O=S(Oc1ccccc1)S(=O)(=O)c1ccc(C2CCCCC2)cc1.[H][H].[H][H].[H][H]
InChIInChI=1S/C19H13NO6S.C18H11NO5S.C18H20O4S2.C15H8F3NO5S.C15H11NO6S.C15H11NO5S.C15H16O4S2.C14H9NO5S.C12F10O4S2.C12H22O4S2.3H2/c1-24-16-10-11-17(13-7-3-2-6-12(13)16)25-27(23)26-20-18(21)14-8-4-5-9-15(14)19(20)22;20-17-14-9-3-4-10-15(14)18(21)19(17)24-25(22)23-16-11-5-7-12-6-1-2-8-13(12)16;19-23(22-17-9-5-2-6-10-17)24(20,21)18-13-11-16(12-14-18)15-7-3-1-4-8-15;16-15(17,18)9-5-7-10(8-6-9)23-25(22)24-19-13(20)11-3-1-2-4-12(11)14(19)21;1-20-10-6-8-11(9-7-10)21-23(19)22-16-14(17)12-4-2-3-5-13(12)15(16)18;1-10-6-8-11(9-7-10)20-22(19)21-16-14(17)12-4-2-3-5-13(12)15(16)18;1-12(2)13-8-10-15(11-9-13)21(17,18)20(16)19-14-6-4-3-5-7-14;16-13-11-8-4-5-9-12(11)14(17)15(13)20-21(18)19-10-6-2-1-3-7-10;13-1-3(15)7(19)11(8(20)4(1)16)26-27(23)28(24,25)12-9(21)5(17)2(14)6(18)10(12)22;13-17(16-11-7-3-1-4-8-11)18(14,15)12-9-5-2-6-10-12;;;/h2-11H,1H3;1-11H;2,5-6,9-15H,1,3-4,7-8H2;1-8H;2-9H,1H3;2-9H,1H3;3-12H,1-2H3;1-9H;;11-12H,1-10H2;3*1H
InChIKeyFTOWZTFDJUFNOO-UHFFFAOYSA-N
MW3513.60 g/mol
LogP29.20
Rot. Bonds44

About 1-cyclohexyl-4-phenoxysulfinylsulfonylbenzene;cyclohexylsulfonylsulfinyloxycyclohexane;(1,3-dioxoisoindol-2-yl) (4-methoxynaphthalen-1-yl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methoxyphenyl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methylphenyl) sulfite;(1,3-dioxoisoindol-2-yl) naphthalen-1-yl sulfite;(1,3-dioxoisoindol-2-yl) phenyl sulfite;(1,3-dioxoisoindol-2-yl) [4-(trifluoromethyl)phenyl] sulfite;molecular hydrogen;1,2,3,4,5-pentafluoro-6-(2,3,4,5,6-pentafluorophenyl)sulfonylsulfinyloxybenzene;1-phenoxysulfinylsulfonyl-4-propan-2-ylbenzene

1-cyclohexyl-4-phenoxysulfinylsulfonylbenzene;cyclohexylsulfonylsulfinyloxycyclohexane;(1,3-dioxoisoindol-2-yl) (4-methoxynaphthalen-1-yl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methoxyphenyl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methylphenyl) sulfite;(1,3-dioxoisoindol-2-yl) naphthalen-1-yl sulfite;(1,3-dioxoisoindol-2-yl) phenyl sulfite;(1,3-dioxoisoindol-2-yl) [4-(trifluoromethyl)phenyl] sulfite;molecular hydrogen;1,2,3,4,5-pentafluoro-6-(2,3,4,5,6-pentafluorophenyl)sulfonylsulfinyloxybenzene;1-phenoxysulfinylsulfonyl-4-propan-2-ylbenzene (PubChem CID 158137996) has the molecular formula C153H127F13N6O48S14 and a molecular weight of 3513.60 g/mol. Its IUPAC name is 1-cyclohexyl-4-phenoxysulfinylsulfonylbenzene;cyclohexylsulfonylsulfinyloxycyclohexane;(1,3-dioxoisoindol-2-yl) (4-methoxynaphthalen-1-yl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methoxyphenyl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methylphenyl) sulfite;(1,3-dioxoisoindol-2-yl) naphthalen-1-yl sulfite;(1,3-dioxoisoindol-2-yl) phenyl sulfite;(1,3-dioxoisoindol-2-yl) [4-(trifluoromethyl)phenyl] sulfite;molecular hydrogen;1,2,3,4,5-pentafluoro-6-(2,3,4,5,6-pentafluorophenyl)sulfonylsulfinyloxybenzene;1-phenoxysulfinylsulfonyl-4-propan-2-ylbenzene.

Molecular Properties

Compound Name1-cyclohexyl-4-phenoxysulfinylsulfonylbenzene;cyclohexylsulfonylsulfinyloxycyclohexane;(1,3-dioxoisoindol-2-yl) (4-methoxynaphthalen-1-yl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methoxyphenyl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methylphenyl) sulfite;(1,3-dioxoisoindol-2-yl) naphthalen-1-yl sulfite;(1,3-dioxoisoindol-2-yl) phenyl sulfite;(1,3-dioxoisoindol-2-yl) [4-(trifluoromethyl)phenyl] sulfite;molecular hydrogen;1,2,3,4,5-pentafluoro-6-(2,3,4,5,6-pentafluorophenyl)sulfonylsulfinyloxybenzene;1-phenoxysulfinylsulfonyl-4-propan-2-ylbenzene
PubChem CID158137996
Molecular FormulaC153H127F13N6O48S14
Molecular Weight3513.60 g/mol
Exact Mass3510.36
IUPAC Name1-cyclohexyl-4-phenoxysulfinylsulfonylbenzene;cyclohexylsulfonylsulfinyloxycyclohexane;(1,3-dioxoisoindol-2-yl) (4-methoxynaphthalen-1-yl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methoxyphenyl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methylphenyl) sulfite;(1,3-dioxoisoindol-2-yl) naphthalen-1-yl sulfite;(1,3-dioxoisoindol-2-yl) phenyl sulfite;(1,3-dioxoisoindol-2-yl) [4-(trifluoromethyl)phenyl] sulfite;molecular hydrogen;1,2,3,4,5-pentafluoro-6-(2,3,4,5,6-pentafluorophenyl)sulfonylsulfinyloxybenzene;1-phenoxysulfinylsulfonyl-4-propan-2-ylbenzene
SMILESCC(C)c1ccc(S(=O)(=O)S(=O)Oc2ccccc2)cc1.COc1ccc(OS(=O)ON2C(=O)c3ccccc3C2=O)c2ccccc12.COc1ccc(OS(=O)ON2C(=O)c3ccccc3C2=O)cc1.Cc1ccc(OS(=O)ON2C(=O)c3ccccc3C2=O)cc1.O=C1c2ccccc2C(=O)N1OS(=O)Oc1ccc(C(F)(F)F)cc1.O=C1c2ccccc2C(=O)N1OS(=O)Oc1cccc2ccccc12.O=C1c2ccccc2C(=O)N1OS(=O)Oc1ccccc1.O=S(OC1CCCCC1)S(=O)(=O)C1CCCCC1.O=S(Oc1c(F)c(F)c(F)c(F)c1F)S(=O)(=O)c1c(F)c(F)c(F)c(F)c1F.O=S(Oc1ccccc1)S(=O)(=O)c1ccc(C2CCCCC2)cc1.[H][H].[H][H].[H][H]
InChIInChI=1S/C19H13NO6S.C18H11NO5S.C18H20O4S2.C15H8F3NO5S.C15H11NO6S.C15H11NO5S.C15H16O4S2.C14H9NO5S.C12F10O4S2.C12H22O4S2.3H2/c1-24-16-10-11-17(13-7-3-2-6-12(13)16)25-27(23)26-20-18(21)14-8-4-5-9-15(14)19(20)22;20-17-14-9-3-4-10-15(14)18(21)19(17)24-25(22)23-16-11-5-7-12-6-1-2-8-13(12)16;19-23(22-17-9-5-2-6-10-17)24(20,21)18-13-11-16(12-14-18)15-7-3-1-4-8-15;16-15(17,18)9-5-7-10(8-6-9)23-25(22)24-19-13(20)11-3-1-2-4-12(11)14(19)21;1-20-10-6-8-11(9-7-10)21-23(19)22-16-14(17)12-4-2-3-5-13(12)15(16)18;1-10-6-8-11(9-7-10)20-22(19)21-16-14(17)12-4-2-3-5-13(12)15(16)18;1-12(2)13-8-10-15(11-9-13)21(17,18)20(16)19-14-6-4-3-5-7-14;16-13-11-8-4-5-9-12(11)14(17)15(13)20-21(18)19-10-6-2-1-3-7-10;13-1-3(15)7(19)11(8(20)4(1)16)26-27(23)28(24,25)12-9(21)5(17)2(14)6(18)10(12)22;13-17(16-11-7-3-1-4-8-11)18(14,15)12-9-5-2-6-10-12;;;/h2-11H,1H3;1-11H;2,5-6,9-15H,1,3-4,7-8H2;1-8H;2-9H,1H3;2-9H,1H3;3-12H,1-2H3;1-9H;;11-12H,1-10H2;3*1H
InChIKeyFTOWZTFDJUFNOO-UHFFFAOYSA-N
XLogP29.20
TPSA697.68 Ų
H-Bond Donors
H-Bond Acceptors48
Rotatable Bonds44
Heavy Atoms234
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003513.60
LogP ≤ 529.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1048

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'disulphide', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

Analyze 1-cyclohexyl-4-phenoxysulfinylsulfonylbenzene;cyclohexylsulfonylsulfinyloxycyclohexane;(1,3-dioxoisoindol-2-yl) (4-methoxynaphthalen-1-yl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methoxyphenyl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methylphenyl) sulfite;(1,3-dioxoisoindol-2-yl) naphthalen-1-yl sulfite;(1,3-dioxoisoindol-2-yl) phenyl sulfite;(1,3-dioxoisoindol-2-yl) [4-(trifluoromethyl)phenyl] sulfite;molecular hydrogen;1,2,3,4,5-pentafluoro-6-(2,3,4,5,6-pentafluorophenyl)sulfonylsulfinyloxybenzene;1-phenoxysulfinylsulfonyl-4-propan-2-ylbenzene with MolForge

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Related Compounds

(1,3-Dioxoisoindol-2-yl) (4-methoxynaphthalen-1-yl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methoxyphenyl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methylphenyl) sulfite;(1,3-dioxoisoindol-2-yl) naphthalen-1-yl sulfite;(1,3-dioxoisoindol-2-yl) [4-(trifluoromethyl)phenyl] sulfite
CID 157731429
(1,3-Dioxoisoindol-2-yl) (4-methoxynaphthalen-1-yl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methoxyphenyl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methylphenyl) sulfite;(1,3-dioxoisoindol-2-yl) naphthalen-1-yl sulfite;(1,3-dioxoisoindol-2-yl) phenyl sulfite;(1,3-dioxoisoindol-2-yl) [4-(trifluoromethyl)phenyl] sulfite;(2,5-dioxo-3-phenylpyrrol-1-yl) phenyl sulfite;(2,5-dioxopyrrol-1-yl) ethyl sulfite;(2,5-dioxopyrrol-1-yl) phenyl sulfite
CID 158314970
Cyclohexyloxysulfinyl cyclohexanesulfinate;(1,3-dioxoisoindol-2-yl) (4-methoxyphenyl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methylphenyl) sulfite;(1,3-dioxoisoindol-2-yl) naphthalen-1-yl sulfite;(1,3-dioxoisoindol-2-yl) phenyl sulfite;(1,3-dioxoisoindol-2-yl) [4-(trifluoromethyl)phenyl] sulfite;molecular hydrogen;(2,3,4,5,6-pentafluorophenoxy)sulfinyl 2,3,4,5,6-pentafluorobenzenesulfinate;phenoxysulfinyl 4-cyclohexylbenzenesulfinate;phenoxysulfinyl 4-propan-2-ylbenzenesulfinate
CID 158343017
(1,3-Dioxoisoindol-2-yl) (4-methoxynaphthalen-1-yl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methoxyphenyl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methylphenyl) sulfite;(1,3-dioxoisoindol-2-yl) naphthalen-1-yl sulfite;(1,3-dioxoisoindol-2-yl) phenyl sulfite;(1,3-dioxoisoindol-2-yl) [4-(trifluoromethyl)phenyl] sulfite;(2,5-dioxopyrrol-1-yl) phenyl sulfite;molecular hydrogen;(2,3,4,5,6-pentafluorophenoxy)sulfinyl 2,3,4,5,6-pentafluorobenzenesulfinate;phenoxysulfinyl 4-cyclohexylbenzenesulfinate
CID 158905357
(1,3-Dioxoisoindol-2-yl) (4-methoxynaphthalen-1-yl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methoxyphenyl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methylphenyl) sulfite;(1,3-dioxoisoindol-2-yl) naphthalen-1-yl sulfite;(1,3-dioxoisoindol-2-yl) phenyl sulfite;(1,3-dioxoisoindol-2-yl) [4-(trifluoromethyl)phenyl] sulfite;(2,5-dioxopyrrol-1-yl) ethyl sulfite;molecular hydrogen;(2,3,4,5,6-pentafluorophenoxy)sulfinyl 2,3,4,5,6-pentafluorobenzenesulfinate;phenoxysulfinyl 4-cyclohexylbenzenesulfinate
CID 161059422
(1,3-Dioxoisoindol-2-yl) (4-methoxyphenyl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methylnaphthalen-1-yl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methylphenyl) sulfite;(1,3-dioxoisoindol-2-yl) naphthalen-1-yl sulfite;(1,3-dioxoisoindol-2-yl) phenyl sulfite;(1,3-dioxoisoindol-2-yl) [4-(trifluoromethyl)phenyl] sulfite;(2,5-dioxo-3-phenylpyrrol-1-yl) phenyl sulfite;(2,5-dioxopyrrol-1-yl) ethyl sulfite;(2,5-dioxopyrrol-1-yl) phenyl sulfite;hydrate
CID 161768001

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-4-phenoxysulfinylsulfonylbenzene;cyclohexylsulfonylsulfinyloxycyclohexane;(1,3-dioxoisoindol-2-yl) (4-methoxynaphthalen-1-yl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methoxyphenyl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methylphenyl) sulfite;(1,3-dioxoisoindol-2-yl) naphthalen-1-yl sulfite;(1,3-dioxoisoindol-2-yl) phenyl sulfite;(1,3-dioxoisoindol-2-yl) [4-(trifluoromethyl)phenyl] sulfite;molecular hydrogen;1,2,3,4,5-pentafluoro-6-(2,3,4,5,6-pentafluorophenyl)sulfonylsulfinyloxybenzene;1-phenoxysulfinylsulfonyl-4-propan-2-ylbenzene?
The IUPAC name of 1-cyclohexyl-4-phenoxysulfinylsulfonylbenzene;cyclohexylsulfonylsulfinyloxycyclohexane;(1,3-dioxoisoindol-2-yl) (4-methoxynaphthalen-1-yl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methoxyphenyl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methylphenyl) sulfite;(1,3-dioxoisoindol-2-yl) naphthalen-1-yl sulfite;(1,3-dioxoisoindol-2-yl) phenyl sulfite;(1,3-dioxoisoindol-2-yl) [4-(trifluoromethyl)phenyl] sulfite;molecular hydrogen;1,2,3,4,5-pentafluoro-6-(2,3,4,5,6-pentafluorophenyl)sulfonylsulfinyloxybenzene;1-phenoxysulfinylsulfonyl-4-propan-2-ylbenzene (CID 158137996) is 1-cyclohexyl-4-phenoxysulfinylsulfonylbenzene;cyclohexylsulfonylsulfinyloxycyclohexane;(1,3-dioxoisoindol-2-yl) (4-methoxynaphthalen-1-yl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methoxyphenyl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methylphenyl) sulfite;(1,3-dioxoisoindol-2-yl) naphthalen-1-yl sulfite;(1,3-dioxoisoindol-2-yl) phenyl sulfite;(1,3-dioxoisoindol-2-yl) [4-(trifluoromethyl)phenyl] sulfite;molecular hydrogen;1,2,3,4,5-pentafluoro-6-(2,3,4,5,6-pentafluorophenyl)sulfonylsulfinyloxybenzene;1-phenoxysulfinylsulfonyl-4-propan-2-ylbenzene.
What is the SMILES notation for 1-cyclohexyl-4-phenoxysulfinylsulfonylbenzene;cyclohexylsulfonylsulfinyloxycyclohexane;(1,3-dioxoisoindol-2-yl) (4-methoxynaphthalen-1-yl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methoxyphenyl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methylphenyl) sulfite;(1,3-dioxoisoindol-2-yl) naphthalen-1-yl sulfite;(1,3-dioxoisoindol-2-yl) phenyl sulfite;(1,3-dioxoisoindol-2-yl) [4-(trifluoromethyl)phenyl] sulfite;molecular hydrogen;1,2,3,4,5-pentafluoro-6-(2,3,4,5,6-pentafluorophenyl)sulfonylsulfinyloxybenzene;1-phenoxysulfinylsulfonyl-4-propan-2-ylbenzene?
The canonical SMILES for 1-cyclohexyl-4-phenoxysulfinylsulfonylbenzene;cyclohexylsulfonylsulfinyloxycyclohexane;(1,3-dioxoisoindol-2-yl) (4-methoxynaphthalen-1-yl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methoxyphenyl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methylphenyl) sulfite;(1,3-dioxoisoindol-2-yl) naphthalen-1-yl sulfite;(1,3-dioxoisoindol-2-yl) phenyl sulfite;(1,3-dioxoisoindol-2-yl) [4-(trifluoromethyl)phenyl] sulfite;molecular hydrogen;1,2,3,4,5-pentafluoro-6-(2,3,4,5,6-pentafluorophenyl)sulfonylsulfinyloxybenzene;1-phenoxysulfinylsulfonyl-4-propan-2-ylbenzene is CC(C)c1ccc(S(=O)(=O)S(=O)Oc2ccccc2)cc1.COc1ccc(OS(=O)ON2C(=O)c3ccccc3C2=O)c2ccccc12.COc1ccc(OS(=O)ON2C(=O)c3ccccc3C2=O)cc1.Cc1ccc(OS(=O)ON2C(=O)c3ccccc3C2=O)cc1.O=C1c2ccccc2C(=O)N1OS(=O)Oc1ccc(C(F)(F)F)cc1.O=C1c2ccccc2C(=O)N1OS(=O)Oc1cccc2ccccc12.O=C1c2ccccc2C(=O)N1OS(=O)Oc1ccccc1.O=S(OC1CCCCC1)S(=O)(=O)C1CCCCC1.O=S(Oc1c(F)c(F)c(F)c(F)c1F)S(=O)(=O)c1c(F)c(F)c(F)c(F)c1F.O=S(Oc1ccccc1)S(=O)(=O)c1ccc(C2CCCCC2)cc1.[H][H].[H][H].[H][H].
What is the InChIKey of 1-cyclohexyl-4-phenoxysulfinylsulfonylbenzene;cyclohexylsulfonylsulfinyloxycyclohexane;(1,3-dioxoisoindol-2-yl) (4-methoxynaphthalen-1-yl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methoxyphenyl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methylphenyl) sulfite;(1,3-dioxoisoindol-2-yl) naphthalen-1-yl sulfite;(1,3-dioxoisoindol-2-yl) phenyl sulfite;(1,3-dioxoisoindol-2-yl) [4-(trifluoromethyl)phenyl] sulfite;molecular hydrogen;1,2,3,4,5-pentafluoro-6-(2,3,4,5,6-pentafluorophenyl)sulfonylsulfinyloxybenzene;1-phenoxysulfinylsulfonyl-4-propan-2-ylbenzene?
The InChIKey is FTOWZTFDJUFNOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13NO6S.C18H11NO5S.C18H20O4S2.C15H8F3NO5S.C15H11NO6S.C15H11NO5S.C15H16O4S2.C14H9NO5S.C12F10O4S2.C12H22O4S2.3H2/c1-24-16-10-11-17(13-7-3-2-6-12(13)16)25-27(23)26-20-18(21)14-8-4-5-9-15(14)19(20)22;20-17-14-9-3-4-10-15(14)18(21)19(17)24-25(22)23-16-11-5-7-12-6-1-2-8-13(12)16;19-23(22-17-9-5-2-6-10-17)24(20,21)18-13-11-16(12-14-18)15-7-3-1-4-8-15;16-15(17,18)9-5-7-10(8-6-9)23-25(22)24-19-13(20)11-3-1-2-4-12(11)14(19)21;1-20-10-6-8-11(9-7-10)21-23(19)22-16-14(17)12-4-2-3-5-13(12)15(16)18;1-10-6-8-11(9-7-10)20-22(19)21-16-14(17)12-4-2-3-5-13(12)15(16)18;1-12(2)13-8-10-15(11-9-13)21(17,18)20(16)19-14-6-4-3-5-7-14;16-13-11-8-4-5-9-12(11)14(17)15(13)20-21(18)19-10-6-2-1-3-7-10;13-1-3(15)7(19)11(8(20)4(1)16)26-27(23)28(24,25)12-9(21)5(17)2(14)6(18)10(12)22;13-17(16-11-7-3-1-4-8-11)18(14,15)12-9-5-2-6-10-12;;;/h2-11H,1H3;1-11H;2,5-6,9-15H,1,3-4,7-8H2;1-8H;2-9H,1H3;2-9H,1H3;3-12H,1-2H3;1-9H;;11-12H,1-10H2;3*1H.
What are the key properties of 1-cyclohexyl-4-phenoxysulfinylsulfonylbenzene;cyclohexylsulfonylsulfinyloxycyclohexane;(1,3-dioxoisoindol-2-yl) (4-methoxynaphthalen-1-yl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methoxyphenyl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methylphenyl) sulfite;(1,3-dioxoisoindol-2-yl) naphthalen-1-yl sulfite;(1,3-dioxoisoindol-2-yl) phenyl sulfite;(1,3-dioxoisoindol-2-yl) [4-(trifluoromethyl)phenyl] sulfite;molecular hydrogen;1,2,3,4,5-pentafluoro-6-(2,3,4,5,6-pentafluorophenyl)sulfonylsulfinyloxybenzene;1-phenoxysulfinylsulfonyl-4-propan-2-ylbenzene?
1-cyclohexyl-4-phenoxysulfinylsulfonylbenzene;cyclohexylsulfonylsulfinyloxycyclohexane;(1,3-dioxoisoindol-2-yl) (4-methoxynaphthalen-1-yl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methoxyphenyl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methylphenyl) sulfite;(1,3-dioxoisoindol-2-yl) naphthalen-1-yl sulfite;(1,3-dioxoisoindol-2-yl) phenyl sulfite;(1,3-dioxoisoindol-2-yl) [4-(trifluoromethyl)phenyl] sulfite;molecular hydrogen;1,2,3,4,5-pentafluoro-6-(2,3,4,5,6-pentafluorophenyl)sulfonylsulfinyloxybenzene;1-phenoxysulfinylsulfonyl-4-propan-2-ylbenzene has a molecular weight of 3513.60 g/mol, XLogP of 29.20, 44 rotatable bonds, 0 hydrogen bond donors, and 48 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-4-phenoxysulfinylsulfonylbenzene;cyclohexylsulfonylsulfinyloxycyclohexane;(1,3-dioxoisoindol-2-yl) (4-methoxynaphthalen-1-yl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methoxyphenyl) sulfite;(1,3-dioxoisoindol-2-yl) (4-methylphenyl) sulfite;(1,3-dioxoisoindol-2-yl) naphthalen-1-yl sulfite;(1,3-dioxoisoindol-2-yl) phenyl sulfite;(1,3-dioxoisoindol-2-yl) [4-(trifluoromethyl)phenyl] sulfite;molecular hydrogen;1,2,3,4,5-pentafluoro-6-(2,3,4,5,6-pentafluorophenyl)sulfonylsulfinyloxybenzene;1-phenoxysulfinylsulfonyl-4-propan-2-ylbenzene is sourced from PubChem (CID 158137996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).