[2-[3-tert-butyl-2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[5-tert-butyl-2-(methoxymethoxy)-3-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-3,5-dimethylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane

C106H152O10P10 — CID 158995702

IUPAC[2-[3-tert-butyl-2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[5-tert-butyl-2-(methoxymethoxy)-3-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-3,5-dimethylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane
SMILESCOCOc1c(C)cc(C(C)(C)C)cc1Pc1c(C)cccc1P(C)C.COCOc1c(C)cc(C)cc1Pc1c(C)cccc1P(C)C.COCOc1c(Pc2c(C)cccc2P(C)C)cc(C(C)(C)C)cc1C(C)(C)C.COCOc1c(Pc2c(C)cccc2P(C)C)cc(C)cc1C(C)(C)C.COCOc1ccc(C)cc1Pc1c(C)cccc1P(C)C
InChIInChI=1S/C25H38O2P2.2C22H32O2P2.C19H26O2P2.C18H24O2P2/c1-17-12-11-13-21(29(9)10)23(17)28-20-15-18(24(2,3)4)14-19(25(5,6)7)22(20)27-16-26-8;1-15-12-17(22(3,4)5)20(24-14-23-6)18(13-15)25-21-16(2)10-9-11-19(21)26(7)8;1-15-10-9-11-19(26(7)8)21(15)25-18-13-17(22(3,4)5)12-16(2)20(18)24-14-23-6;1-13-10-15(3)18(21-12-20-4)16(11-13)22-19-14(2)8-7-9-17(19)23(5)6;1-13-9-10-15(20-12-19-3)16(11-13)21-18-14(2)7-6-8-17(18)22(4)5/h11-15,28H,16H2,1-10H3;2*9-13,25H,14H2,1-8H3;7-11,22H,12H2,1-6H3;6-11,21H,12H2,1-5H3
InChIKeyJQSFSUHKLRIWHB-UHFFFAOYSA-N
MW1896.11 g/mol
LogP21.60
Rot. Bonds30

About [2-[3-tert-butyl-2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[5-tert-butyl-2-(methoxymethoxy)-3-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-3,5-dimethylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane

[2-[3-tert-butyl-2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[5-tert-butyl-2-(methoxymethoxy)-3-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-3,5-dimethylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane (PubChem CID 158995702) has the molecular formula C106H152O10P10 and a molecular weight of 1896.11 g/mol. Its IUPAC name is [2-[3-tert-butyl-2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[5-tert-butyl-2-(methoxymethoxy)-3-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-3,5-dimethylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane.

Molecular Properties

Compound Name[2-[3-tert-butyl-2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[5-tert-butyl-2-(methoxymethoxy)-3-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-3,5-dimethylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane
PubChem CID158995702
Molecular FormulaC106H152O10P10
Molecular Weight1896.11 g/mol
Exact Mass1894.88
IUPAC Name[2-[3-tert-butyl-2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[5-tert-butyl-2-(methoxymethoxy)-3-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-3,5-dimethylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane
SMILESCOCOc1c(C)cc(C(C)(C)C)cc1Pc1c(C)cccc1P(C)C.COCOc1c(C)cc(C)cc1Pc1c(C)cccc1P(C)C.COCOc1c(Pc2c(C)cccc2P(C)C)cc(C(C)(C)C)cc1C(C)(C)C.COCOc1c(Pc2c(C)cccc2P(C)C)cc(C)cc1C(C)(C)C.COCOc1ccc(C)cc1Pc1c(C)cccc1P(C)C
InChIInChI=1S/C25H38O2P2.2C22H32O2P2.C19H26O2P2.C18H24O2P2/c1-17-12-11-13-21(29(9)10)23(17)28-20-15-18(24(2,3)4)14-19(25(5,6)7)22(20)27-16-26-8;1-15-12-17(22(3,4)5)20(24-14-23-6)18(13-15)25-21-16(2)10-9-11-19(21)26(7)8;1-15-10-9-11-19(26(7)8)21(15)25-18-13-17(22(3,4)5)12-16(2)20(18)24-14-23-6;1-13-10-15(3)18(21-12-20-4)16(11-13)22-19-14(2)8-7-9-17(19)23(5)6;1-13-9-10-15(20-12-19-3)16(11-13)21-18-14(2)7-6-8-17(18)22(4)5/h11-15,28H,16H2,1-10H3;2*9-13,25H,14H2,1-8H3;7-11,22H,12H2,1-6H3;6-11,21H,12H2,1-5H3
InChIKeyJQSFSUHKLRIWHB-UHFFFAOYSA-N
XLogP21.60
TPSA92.30 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds30
Heavy Atoms126
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001896.11
LogP ≤ 521.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze [2-[3-tert-butyl-2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[5-tert-butyl-2-(methoxymethoxy)-3-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-3,5-dimethylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane with MolForge

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Frequently Asked Questions

What is the IUPAC name of [2-[3-tert-butyl-2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[5-tert-butyl-2-(methoxymethoxy)-3-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-3,5-dimethylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane?
The IUPAC name of [2-[3-tert-butyl-2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[5-tert-butyl-2-(methoxymethoxy)-3-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-3,5-dimethylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane (CID 158995702) is [2-[3-tert-butyl-2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[5-tert-butyl-2-(methoxymethoxy)-3-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-3,5-dimethylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane.
What is the SMILES notation for [2-[3-tert-butyl-2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[5-tert-butyl-2-(methoxymethoxy)-3-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-3,5-dimethylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane?
The canonical SMILES for [2-[3-tert-butyl-2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[5-tert-butyl-2-(methoxymethoxy)-3-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-3,5-dimethylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane is COCOc1c(C)cc(C(C)(C)C)cc1Pc1c(C)cccc1P(C)C.COCOc1c(C)cc(C)cc1Pc1c(C)cccc1P(C)C.COCOc1c(Pc2c(C)cccc2P(C)C)cc(C(C)(C)C)cc1C(C)(C)C.COCOc1c(Pc2c(C)cccc2P(C)C)cc(C)cc1C(C)(C)C.COCOc1ccc(C)cc1Pc1c(C)cccc1P(C)C.
What is the InChIKey of [2-[3-tert-butyl-2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[5-tert-butyl-2-(methoxymethoxy)-3-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-3,5-dimethylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane?
The InChIKey is JQSFSUHKLRIWHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H38O2P2.2C22H32O2P2.C19H26O2P2.C18H24O2P2/c1-17-12-11-13-21(29(9)10)23(17)28-20-15-18(24(2,3)4)14-19(25(5,6)7)22(20)27-16-26-8;1-15-12-17(22(3,4)5)20(24-14-23-6)18(13-15)25-21-16(2)10-9-11-19(21)26(7)8;1-15-10-9-11-19(26(7)8)21(15)25-18-13-17(22(3,4)5)12-16(2)20(18)24-14-23-6;1-13-10-15(3)18(21-12-20-4)16(11-13)22-19-14(2)8-7-9-17(19)23(5)6;1-13-9-10-15(20-12-19-3)16(11-13)21-18-14(2)7-6-8-17(18)22(4)5/h11-15,28H,16H2,1-10H3;2*9-13,25H,14H2,1-8H3;7-11,22H,12H2,1-6H3;6-11,21H,12H2,1-5H3.
What are the key properties of [2-[3-tert-butyl-2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[5-tert-butyl-2-(methoxymethoxy)-3-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-3,5-dimethylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane?
[2-[3-tert-butyl-2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[5-tert-butyl-2-(methoxymethoxy)-3-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-3,5-dimethylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane has a molecular weight of 1896.11 g/mol, XLogP of 21.60, 30 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[3-tert-butyl-2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[5-tert-butyl-2-(methoxymethoxy)-3-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[3,5-ditert-butyl-2-(methoxymethoxy)phenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-3,5-dimethylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane;[2-[2-(methoxymethoxy)-5-methylphenyl]phosphanyl-3-methylphenyl]-dimethylphosphane is sourced from PubChem (CID 158995702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).