(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) adamantane-2-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-1-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-2-carboxylate;2-(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl)oxycarbonylcyclohexane-1-carboxylic acid;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) tetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylate;pentakis(triphenylsulfanium)

C159H137F25O27S10 — CID 159417175

About (1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) adamantane-2-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-1-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-2-carboxylate;2-(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl)oxycarbonylcyclohexane-1-carboxylic acid;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) tetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylate;pentakis(triphenylsulfanium)

(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) adamantane-2-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-1-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-2-carboxylate;2-(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl)oxycarbonylcyclohexane-1-carboxylic acid;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) tetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylate;pentakis(triphenylsulfanium) (PubChem CID 159417175) has the molecular formula C159H137F25O27S10 and a molecular weight of 3275.44 g/mol. Its IUPAC name is (1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) adamantane-2-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-1-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-2-carboxylate;2-(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl)oxycarbonylcyclohexane-1-carboxylic acid;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) tetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylate;pentakis(triphenylsulfanium).

Molecular Properties

• Compound Name: (1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) adamantane-2-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-1-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-2-carboxylate;2-(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl)oxycarbonylcyclohexane-1-carboxylic acid;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) tetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylate;pentakis(triphenylsulfanium)
• PubChem CID: 159417175
• Molecular Formula: C159H137F25O27S10
• Molecular Weight: 3275.44 g/mol
• Exact Mass: 3272.62
• IUPAC Name: (1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) adamantane-2-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-1-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-2-carboxylate;2-(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl)oxycarbonylcyclohexane-1-carboxylic acid;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) tetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylate;pentakis(triphenylsulfanium)
• SMILES: O=C(O)C1CCCCC1C(=O)OC(C(F)(F)F)C(F)(F)SOO[O-].O=C(OC(C(F)(F)F)C(F)(F)SOO[O-])C1C2CC3CC(C2)CC1C3.O=C(OC(C(F)(F)F)C(F)(F)SOO[O-])C1CC2CC1C1C3CCC(C3)C21.O=C(OC(C(F)(F)F)C(F)(F)SOO[O-])c1ccc2ccccc2c1.O=C(OC(C(F)(F)F)C(F)(F)SOO[O-])c1cccc2ccccc12.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1
• InChI: InChI=1S/5C18H15S.C16H19F5O5S.C14H17F5O5S.2C14H9F5O5S.C11H13F5O7S/c5*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;17-15(18,19)14(16(20,21)27-26-25-23)24-13(22)10-5-8-4-9(10)12-7-2-1-6(3-7)11(8)12;15-13(16,17)12(14(18,19)25-24-23-21)22-11(20)10-8-2-6-1-7(4-8)5-9(10)3-6;15-13(16,17)12(14(18,19)25-24-23-21)22-11(20)10-7-3-5-8-4-1-2-6-9(8)10;15-13(16,17)12(14(18,19)25-24-23-21)22-11(20)10-6-5-8-3-1-2-4-9(8)7-10;12-10(13,14)9(11(15,16)24-23-22-20)21-8(19)6-4-2-1-3-5(6)7(17)18/h5*1-15H;6-12,14,23H,1-5H2;6-10,12,21H,1-5H2;2*1-7,12,21H;5-6,9,20H,1-4H2,(H,17,18)/q5*+1;;;;;/p-5
• InChIKey: LPHNFYGNMVMLGX-UHFFFAOYSA-I
• XLogP: 38.75
• TPSA: 376.40 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 31
• Rotatable Bonds: 46
• Heavy Atoms: 221
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3275.44
LogP ≤ 5	38.75
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	31

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'}, {'alert_name': 'cyclooctane_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) adamantane-2-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-1-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-2-carboxylate;2-(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl)oxycarbonylcyclohexane-1-carboxylic acid;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) tetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylate;pentakis(triphenylsulfanium)?

The IUPAC name of (1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) adamantane-2-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-1-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-2-carboxylate;2-(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl)oxycarbonylcyclohexane-1-carboxylic acid;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) tetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylate;pentakis(triphenylsulfanium) (CID 159417175) is (1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) adamantane-2-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-1-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-2-carboxylate;2-(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl)oxycarbonylcyclohexane-1-carboxylic acid;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) tetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylate;pentakis(triphenylsulfanium).

What is the SMILES notation for (1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) adamantane-2-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-1-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-2-carboxylate;2-(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl)oxycarbonylcyclohexane-1-carboxylic acid;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) tetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylate;pentakis(triphenylsulfanium)?

The canonical SMILES for (1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) adamantane-2-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-1-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-2-carboxylate;2-(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl)oxycarbonylcyclohexane-1-carboxylic acid;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) tetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylate;pentakis(triphenylsulfanium) is O=C(O)C1CCCCC1C(=O)OC(C(F)(F)F)C(F)(F)SOO[O-].O=C(OC(C(F)(F)F)C(F)(F)SOO[O-])C1C2CC3CC(C2)CC1C3.O=C(OC(C(F)(F)F)C(F)(F)SOO[O-])C1CC2CC1C1C3CCC(C3)C21.O=C(OC(C(F)(F)F)C(F)(F)SOO[O-])c1ccc2ccccc2c1.O=C(OC(C(F)(F)F)C(F)(F)SOO[O-])c1cccc2ccccc12.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.

What is the InChIKey of (1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) adamantane-2-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-1-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-2-carboxylate;2-(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl)oxycarbonylcyclohexane-1-carboxylic acid;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) tetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylate;pentakis(triphenylsulfanium)?

The InChIKey is LPHNFYGNMVMLGX-UHFFFAOYSA-I. The full InChI is InChI=1S/5C18H15S.C16H19F5O5S.C14H17F5O5S.2C14H9F5O5S.C11H13F5O7S/c5*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;17-15(18,19)14(16(20,21)27-26-25-23)24-13(22)10-5-8-4-9(10)12-7-2-1-6(3-7)11(8)12;15-13(16,17)12(14(18,19)25-24-23-21)22-11(20)10-8-2-6-1-7(4-8)5-9(10)3-6;15-13(16,17)12(14(18,19)25-24-23-21)22-11(20)10-7-3-5-8-4-1-2-6-9(8)10;15-13(16,17)12(14(18,19)25-24-23-21)22-11(20)10-6-5-8-3-1-2-4-9(8)7-10;12-10(13,14)9(11(15,16)24-23-22-20)21-8(19)6-4-2-1-3-5(6)7(17)18/h5*1-15H;6-12,14,23H,1-5H2;6-10,12,21H,1-5H2;2*1-7,12,21H;5-6,9,20H,1-4H2,(H,17,18)/q5*+1;;;;;/p-5.

What are the key properties of (1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) adamantane-2-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-1-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-2-carboxylate;2-(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl)oxycarbonylcyclohexane-1-carboxylic acid;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) tetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylate;pentakis(triphenylsulfanium)?

(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) adamantane-2-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-1-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-2-carboxylate;2-(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl)oxycarbonylcyclohexane-1-carboxylic acid;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) tetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylate;pentakis(triphenylsulfanium) has a molecular weight of 3275.44 g/mol, XLogP of 38.75, 46 rotatable bonds, 1 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for (1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) adamantane-2-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-1-carboxylate;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) naphthalene-2-carboxylate;2-(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl)oxycarbonylcyclohexane-1-carboxylic acid;(1,1,1,3,3-pentafluoro-3-oxidoperoxysulfanylpropan-2-yl) tetracyclo[6.2.1.13,6.02,7]dodecane-4-carboxylate;pentakis(triphenylsulfanium) is sourced from PubChem (CID 159417175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).