argon;[4-(5-diphenylphosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-diphenylphosphanyl-2,2-difluoro-1,3-benzodioxol-4-yl)-2,2-difluoro-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-phosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]phosphane;(2,4,6-tritert-butylphenyl) hypoiodite

C108H93Ar4F4IO13P6 — CID 160523048

IUPACargon;[4-(5-diphenylphosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-diphenylphosphanyl-2,2-difluoro-1,3-benzodioxol-4-yl)-2,2-difluoro-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-phosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]phosphane;(2,4,6-tritert-butylphenyl) hypoiodite
SMILESCC(C)(C)c1cc(C(C)(C)C)c(OI)c(C(C)(C)C)c1.FC1(F)Oc2ccc(P(c3ccccc3)c3ccccc3)c(-c3c(P(c4ccccc4)c4ccccc4)ccc4c3OC(F)(F)O4)c2O1.Pc1ccc2c(c1-c1c(P)ccc3c1OCO3)OCO2.[Ar].[Ar].[Ar].[Ar].c1ccc(P(c2ccccc2)c2ccc3c(c2-c2c(P(c4ccccc4)c4ccccc4)ccc4c2OCO4)OCO3)cc1
InChIInChI=1S/C38H24F4O4P2.C38H28O4P2.C18H29IO.C14H12O4P2.4Ar/c39-37(40)43-29-21-23-31(47(25-13-5-1-6-14-25)26-15-7-2-8-16-26)33(35(29)45-37)34-32(24-22-30-36(34)46-38(41,42)44-30)48(27-17-9-3-10-18-27)28-19-11-4-12-20-28;1-5-13-27(14-6-1)43(28-15-7-2-8-16-28)33-23-21-31-37(41-25-39-31)35(33)36-34(24-22-32-38(36)42-26-40-32)44(29-17-9-3-10-18-29)30-19-11-4-12-20-30;1-16(2,3)12-10-13(17(4,5)6)15(20-19)14(11-12)18(7,8)9;19-9-3-1-7-13(17-5-15-7)11(9)12-10(20)4-2-8-14(12)18-6-16-8;;;;/h1-24H;1-24H,25-26H2;10-11H,1-9H3;1-4H,5-6,19-20H2;;;;
InChIKeyQUNKMTYRBKTPLJ-UHFFFAOYSA-N
MW2147.45 g/mol
LogP21.96
Rot. Bonds16

About argon;[4-(5-diphenylphosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-diphenylphosphanyl-2,2-difluoro-1,3-benzodioxol-4-yl)-2,2-difluoro-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-phosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]phosphane;(2,4,6-tritert-butylphenyl) hypoiodite

argon;[4-(5-diphenylphosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-diphenylphosphanyl-2,2-difluoro-1,3-benzodioxol-4-yl)-2,2-difluoro-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-phosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]phosphane;(2,4,6-tritert-butylphenyl) hypoiodite (PubChem CID 160523048) has the molecular formula C108H93Ar4F4IO13P6 and a molecular weight of 2147.45 g/mol. Its IUPAC name is argon;[4-(5-diphenylphosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-diphenylphosphanyl-2,2-difluoro-1,3-benzodioxol-4-yl)-2,2-difluoro-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-phosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]phosphane;(2,4,6-tritert-butylphenyl) hypoiodite.

Molecular Properties

Compound Nameargon;[4-(5-diphenylphosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-diphenylphosphanyl-2,2-difluoro-1,3-benzodioxol-4-yl)-2,2-difluoro-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-phosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]phosphane;(2,4,6-tritert-butylphenyl) hypoiodite
PubChem CID160523048
Molecular FormulaC108H93Ar4F4IO13P6
Molecular Weight2147.45 g/mol
Exact Mass2146.25
IUPAC Nameargon;[4-(5-diphenylphosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-diphenylphosphanyl-2,2-difluoro-1,3-benzodioxol-4-yl)-2,2-difluoro-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-phosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]phosphane;(2,4,6-tritert-butylphenyl) hypoiodite
SMILESCC(C)(C)c1cc(C(C)(C)C)c(OI)c(C(C)(C)C)c1.FC1(F)Oc2ccc(P(c3ccccc3)c3ccccc3)c(-c3c(P(c4ccccc4)c4ccccc4)ccc4c3OC(F)(F)O4)c2O1.Pc1ccc2c(c1-c1c(P)ccc3c1OCO3)OCO2.[Ar].[Ar].[Ar].[Ar].c1ccc(P(c2ccccc2)c2ccc3c(c2-c2c(P(c4ccccc4)c4ccccc4)ccc4c2OCO4)OCO3)cc1
InChIInChI=1S/C38H24F4O4P2.C38H28O4P2.C18H29IO.C14H12O4P2.4Ar/c39-37(40)43-29-21-23-31(47(25-13-5-1-6-14-25)26-15-7-2-8-16-26)33(35(29)45-37)34-32(24-22-30-36(34)46-38(41,42)44-30)48(27-17-9-3-10-18-27)28-19-11-4-12-20-28;1-5-13-27(14-6-1)43(28-15-7-2-8-16-28)33-23-21-31-37(41-25-39-31)35(33)36-34(24-22-32-38(36)42-26-40-32)44(29-17-9-3-10-18-29)30-19-11-4-12-20-30;1-16(2,3)12-10-13(17(4,5)6)15(20-19)14(11-12)18(7,8)9;19-9-3-1-7-13(17-5-15-7)11(9)12-10(20)4-2-8-14(12)18-6-16-8;;;;/h1-24H;1-24H,25-26H2;10-11H,1-9H3;1-4H,5-6,19-20H2;;;;
InChIKeyQUNKMTYRBKTPLJ-UHFFFAOYSA-N
XLogP21.96
TPSA119.99 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds16
Heavy Atoms136
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002147.45
LogP ≤ 521.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze argon;[4-(5-diphenylphosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-diphenylphosphanyl-2,2-difluoro-1,3-benzodioxol-4-yl)-2,2-difluoro-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-phosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]phosphane;(2,4,6-tritert-butylphenyl) hypoiodite with MolForge

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Related Compounds

[4-(5-diphenylphosphanyl-2,2-difluoro-1,3-benzodioxol-4-yl)-2,2-difluoro-1,3-benzodioxol-5-yl]-diphenylphosphane;ruthenium(2+);dichloride
CID 51001061
acetic acid;[4-(5-diphenylphosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]-diphenylphosphane;ruthenium
CID 71310596
bis([4-(5-diphenylphosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]-diphenylphosphane);bis(N-methylmethanamine);ruthenium;bis(ruthenium(2+));dichloride;octahydrochloride
CID 175687646
[4-[5-bis(3,5-ditert-butyl-4-methoxyphenyl)phosphanyl-1,3-benzodioxol-4-yl]-1,3-benzodioxol-5-yl]-bis(3,5-ditert-butyl-4-methoxyphenyl)phosphane;[4-[5-bis(3,5-dimethylphenyl)phosphanyl-1,3-benzodioxol-4-yl]-1,3-benzodioxol-5-yl]-bis(3,5-dimethylphenyl)phosphane;[1-[2-bis(3,5-dimethylphenyl)phosphanylnaphthalen-1-yl]naphthalen-2-yl]-bis(3,5-dimethylphenyl)phosphane;[1-[2-bis(4-methylphenyl)phosphanylnaphthalen-1-yl]naphthalen-2-yl]-bis(4-methylphenyl)phosphane
CID 161200246
diphenyl-[4-(5-phenylphosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]phosphane
CID 134839910
CID 16744161
CID 16744161
(1-diphenylphosphanylbenzo[d][1,3]benzodioxepin-11-yl)-diphenylphosphane;[4-(5-diphenylphosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]-diphenylphosphane;[2-(2-diphenylphosphanyl-6-methylphenyl)-3-methylphenyl]-diphenylphosphane;[1-(2-diphenylphosphanylnaphthalen-1-yl)naphthalen-2-yl]-diphenylphosphane
CID 157489097
[4-(5-diphenylphosphanyl-2,2-difluoro-1,3-benzodioxol-4-yl)-2,2-difluoro-6,7-dihydro-1,3-benzodioxol-5-yl]-diphenylphosphane
CID 123857209
chlororuthenium(1+);[4-(5-diphenylphosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]-diphenylphosphane;1-methyl-4-propan-2-ylbenzene;chloride
CID 71310236
[4-[(2R)-2-methyl-1,3-benzodioxol-4-yl]-1,3-benzodioxol-5-yl]-diphenylphosphane
CID 144514545
cyclopentane;dicyclohexyl-[2-[2-[1-[(3,5-dimethylphenyl)-[3-methyl-5-(trifluoromethyl)phenyl]phosphanyl]ethyl]cyclopentyl]phenyl]phosphane;[4-(5-diphenylphosphanyl-2,2-difluoro-1,3-benzodioxol-4-yl)-2,2-difluoro-1,3-benzodioxol-5-yl]-diphenylphosphane;iron
CID 162300087
(6-diphenylphosphanyl-1,3-benzodioxol-5-yl)-diphenylphosphane
CID 18324341

Frequently Asked Questions

What is the IUPAC name of argon;[4-(5-diphenylphosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-diphenylphosphanyl-2,2-difluoro-1,3-benzodioxol-4-yl)-2,2-difluoro-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-phosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]phosphane;(2,4,6-tritert-butylphenyl) hypoiodite?
The IUPAC name of argon;[4-(5-diphenylphosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-diphenylphosphanyl-2,2-difluoro-1,3-benzodioxol-4-yl)-2,2-difluoro-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-phosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]phosphane;(2,4,6-tritert-butylphenyl) hypoiodite (CID 160523048) is argon;[4-(5-diphenylphosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-diphenylphosphanyl-2,2-difluoro-1,3-benzodioxol-4-yl)-2,2-difluoro-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-phosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]phosphane;(2,4,6-tritert-butylphenyl) hypoiodite.
What is the SMILES notation for argon;[4-(5-diphenylphosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-diphenylphosphanyl-2,2-difluoro-1,3-benzodioxol-4-yl)-2,2-difluoro-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-phosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]phosphane;(2,4,6-tritert-butylphenyl) hypoiodite?
The canonical SMILES for argon;[4-(5-diphenylphosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-diphenylphosphanyl-2,2-difluoro-1,3-benzodioxol-4-yl)-2,2-difluoro-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-phosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]phosphane;(2,4,6-tritert-butylphenyl) hypoiodite is CC(C)(C)c1cc(C(C)(C)C)c(OI)c(C(C)(C)C)c1.FC1(F)Oc2ccc(P(c3ccccc3)c3ccccc3)c(-c3c(P(c4ccccc4)c4ccccc4)ccc4c3OC(F)(F)O4)c2O1.Pc1ccc2c(c1-c1c(P)ccc3c1OCO3)OCO2.[Ar].[Ar].[Ar].[Ar].c1ccc(P(c2ccccc2)c2ccc3c(c2-c2c(P(c4ccccc4)c4ccccc4)ccc4c2OCO4)OCO3)cc1.
What is the InChIKey of argon;[4-(5-diphenylphosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-diphenylphosphanyl-2,2-difluoro-1,3-benzodioxol-4-yl)-2,2-difluoro-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-phosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]phosphane;(2,4,6-tritert-butylphenyl) hypoiodite?
The InChIKey is QUNKMTYRBKTPLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H24F4O4P2.C38H28O4P2.C18H29IO.C14H12O4P2.4Ar/c39-37(40)43-29-21-23-31(47(25-13-5-1-6-14-25)26-15-7-2-8-16-26)33(35(29)45-37)34-32(24-22-30-36(34)46-38(41,42)44-30)48(27-17-9-3-10-18-27)28-19-11-4-12-20-28;1-5-13-27(14-6-1)43(28-15-7-2-8-16-28)33-23-21-31-37(41-25-39-31)35(33)36-34(24-22-32-38(36)42-26-40-32)44(29-17-9-3-10-18-29)30-19-11-4-12-20-30;1-16(2,3)12-10-13(17(4,5)6)15(20-19)14(11-12)18(7,8)9;19-9-3-1-7-13(17-5-15-7)11(9)12-10(20)4-2-8-14(12)18-6-16-8;;;;/h1-24H;1-24H,25-26H2;10-11H,1-9H3;1-4H,5-6,19-20H2;;;;.
What are the key properties of argon;[4-(5-diphenylphosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-diphenylphosphanyl-2,2-difluoro-1,3-benzodioxol-4-yl)-2,2-difluoro-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-phosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]phosphane;(2,4,6-tritert-butylphenyl) hypoiodite?
argon;[4-(5-diphenylphosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-diphenylphosphanyl-2,2-difluoro-1,3-benzodioxol-4-yl)-2,2-difluoro-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-phosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]phosphane;(2,4,6-tritert-butylphenyl) hypoiodite has a molecular weight of 2147.45 g/mol, XLogP of 21.96, 16 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for argon;[4-(5-diphenylphosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-diphenylphosphanyl-2,2-difluoro-1,3-benzodioxol-4-yl)-2,2-difluoro-1,3-benzodioxol-5-yl]-diphenylphosphane;[4-(5-phosphanyl-1,3-benzodioxol-4-yl)-1,3-benzodioxol-5-yl]phosphane;(2,4,6-tritert-butylphenyl) hypoiodite is sourced from PubChem (CID 160523048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).