bis([4-(3,4-dimethylphenyl)-2-methylphenyl]phosphane);[4-(3,4-dimethylphenyl)-3-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-2-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-3-methylphenyl]phosphane;[4-(2,4-dimethylphenyl)phenyl]phosphane;[4-(3,4-dimethylphenyl)phenyl]phosphane;[2-methyl-4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(3-methyl-4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane

C181H191P15 — CID 158094684

IUPACbis([4-(3,4-dimethylphenyl)-2-methylphenyl]phosphane);[4-(3,4-dimethylphenyl)-3-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-2-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-3-methylphenyl]phosphane;[4-(2,4-dimethylphenyl)phenyl]phosphane;[4-(3,4-dimethylphenyl)phenyl]phosphane;[2-methyl-4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(3-methyl-4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane
SMILESCc1cc(-c2ccc(-c3ccc(P)c(C)c3)cc2)ccc1P.Cc1cc(-c2ccc(-c3ccc(P)cc3)cc2)ccc1P.Cc1cc(-c2ccc(-c3ccc(P)cc3)cc2C)ccc1P.Cc1cc(-c2ccc(P)cc2)ccc1-c1ccc(P)cc1.Cc1cc(C)cc(-c2ccc(P)c(C)c2)c1.Cc1cc(C)cc(-c2ccc(P)cc2C)c1.Cc1ccc(-c2ccc(P)c(C)c2)cc1C.Cc1ccc(-c2ccc(P)c(C)c2)cc1C.Cc1ccc(-c2ccc(P)cc2)c(C)c1.Cc1ccc(-c2ccc(P)cc2)cc1C.Cc1ccc(-c2ccc(P)cc2C)cc1C
InChIInChI=1S/2C20H20P2.2C19H18P2.5C15H17P.2C14H15P/c1-13-11-16(15-3-7-18(21)8-4-15)5-9-19(13)17-6-10-20(22)14(2)12-17;1-13-11-17(7-9-19(13)21)15-3-5-16(6-4-15)18-8-10-20(22)14(2)12-18;1-13-12-16(14-2-7-17(20)8-3-14)6-11-19(13)15-4-9-18(21)10-5-15;1-13-12-17(8-11-19(13)21)16-4-2-14(3-5-16)15-6-9-18(20)10-7-15;1-10-6-11(2)8-13(7-10)15-5-4-14(16)9-12(15)3;1-10-6-11(2)8-14(7-10)13-4-5-15(16)12(3)9-13;1-10-4-5-13(8-11(10)2)15-7-6-14(16)9-12(15)3;2*1-10-4-5-13(8-11(10)2)14-6-7-15(16)12(3)9-14;1-10-3-8-14(11(2)9-10)12-4-6-13(15)7-5-12;1-10-3-4-13(9-11(10)2)12-5-7-14(15)8-6-12/h2*3-12H,21-22H2,1-2H3;2*2-12H,20-21H2,1H3;5*4-9H,16H2,1-3H3;2*3-9H,15H2,1-2H3
InChIKeyFONHWZHZBIOUGV-UHFFFAOYSA-N
MW2831.13 g/mol
LogP43.77
Rot. Bonds15

About bis([4-(3,4-dimethylphenyl)-2-methylphenyl]phosphane);[4-(3,4-dimethylphenyl)-3-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-2-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-3-methylphenyl]phosphane;[4-(2,4-dimethylphenyl)phenyl]phosphane;[4-(3,4-dimethylphenyl)phenyl]phosphane;[2-methyl-4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(3-methyl-4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane

bis([4-(3,4-dimethylphenyl)-2-methylphenyl]phosphane);[4-(3,4-dimethylphenyl)-3-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-2-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-3-methylphenyl]phosphane;[4-(2,4-dimethylphenyl)phenyl]phosphane;[4-(3,4-dimethylphenyl)phenyl]phosphane;[2-methyl-4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(3-methyl-4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane (PubChem CID 158094684) has the molecular formula C181H191P15 and a molecular weight of 2831.13 g/mol. Its IUPAC name is bis([4-(3,4-dimethylphenyl)-2-methylphenyl]phosphane);[4-(3,4-dimethylphenyl)-3-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-2-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-3-methylphenyl]phosphane;[4-(2,4-dimethylphenyl)phenyl]phosphane;[4-(3,4-dimethylphenyl)phenyl]phosphane;[2-methyl-4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(3-methyl-4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane.

Molecular Properties

Compound Namebis([4-(3,4-dimethylphenyl)-2-methylphenyl]phosphane);[4-(3,4-dimethylphenyl)-3-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-2-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-3-methylphenyl]phosphane;[4-(2,4-dimethylphenyl)phenyl]phosphane;[4-(3,4-dimethylphenyl)phenyl]phosphane;[2-methyl-4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(3-methyl-4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane
PubChem CID158094684
Molecular FormulaC181H191P15
Molecular Weight2831.13 g/mol
Exact Mass2829.10
IUPAC Namebis([4-(3,4-dimethylphenyl)-2-methylphenyl]phosphane);[4-(3,4-dimethylphenyl)-3-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-2-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-3-methylphenyl]phosphane;[4-(2,4-dimethylphenyl)phenyl]phosphane;[4-(3,4-dimethylphenyl)phenyl]phosphane;[2-methyl-4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(3-methyl-4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane
SMILESCc1cc(-c2ccc(-c3ccc(P)c(C)c3)cc2)ccc1P.Cc1cc(-c2ccc(-c3ccc(P)cc3)cc2)ccc1P.Cc1cc(-c2ccc(-c3ccc(P)cc3)cc2C)ccc1P.Cc1cc(-c2ccc(P)cc2)ccc1-c1ccc(P)cc1.Cc1cc(C)cc(-c2ccc(P)c(C)c2)c1.Cc1cc(C)cc(-c2ccc(P)cc2C)c1.Cc1ccc(-c2ccc(P)c(C)c2)cc1C.Cc1ccc(-c2ccc(P)c(C)c2)cc1C.Cc1ccc(-c2ccc(P)cc2)c(C)c1.Cc1ccc(-c2ccc(P)cc2)cc1C.Cc1ccc(-c2ccc(P)cc2C)cc1C
InChIInChI=1S/2C20H20P2.2C19H18P2.5C15H17P.2C14H15P/c1-13-11-16(15-3-7-18(21)8-4-15)5-9-19(13)17-6-10-20(22)14(2)12-17;1-13-11-17(7-9-19(13)21)15-3-5-16(6-4-15)18-8-10-20(22)14(2)12-18;1-13-12-16(14-2-7-17(20)8-3-14)6-11-19(13)15-4-9-18(21)10-5-15;1-13-12-17(8-11-19(13)21)16-4-2-14(3-5-16)15-6-9-18(20)10-7-15;1-10-6-11(2)8-13(7-10)15-5-4-14(16)9-12(15)3;1-10-6-11(2)8-14(7-10)13-4-5-15(16)12(3)9-13;1-10-4-5-13(8-11(10)2)15-7-6-14(16)9-12(15)3;2*1-10-4-5-13(8-11(10)2)14-6-7-15(16)12(3)9-14;1-10-3-8-14(11(2)9-10)12-4-6-13(15)7-5-12;1-10-3-4-13(9-11(10)2)12-5-7-14(15)8-6-12/h2*3-12H,21-22H2,1-2H3;2*2-12H,20-21H2,1H3;5*4-9H,16H2,1-3H3;2*3-9H,15H2,1-2H3
InChIKeyFONHWZHZBIOUGV-UHFFFAOYSA-N
XLogP43.77
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds15
Heavy Atoms196
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002831.13
LogP ≤ 543.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze bis([4-(3,4-dimethylphenyl)-2-methylphenyl]phosphane);[4-(3,4-dimethylphenyl)-3-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-2-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-3-methylphenyl]phosphane;[4-(2,4-dimethylphenyl)phenyl]phosphane;[4-(3,4-dimethylphenyl)phenyl]phosphane;[2-methyl-4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(3-methyl-4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane with MolForge

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Frequently Asked Questions

What is the IUPAC name of bis([4-(3,4-dimethylphenyl)-2-methylphenyl]phosphane);[4-(3,4-dimethylphenyl)-3-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-2-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-3-methylphenyl]phosphane;[4-(2,4-dimethylphenyl)phenyl]phosphane;[4-(3,4-dimethylphenyl)phenyl]phosphane;[2-methyl-4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(3-methyl-4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane?
The IUPAC name of bis([4-(3,4-dimethylphenyl)-2-methylphenyl]phosphane);[4-(3,4-dimethylphenyl)-3-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-2-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-3-methylphenyl]phosphane;[4-(2,4-dimethylphenyl)phenyl]phosphane;[4-(3,4-dimethylphenyl)phenyl]phosphane;[2-methyl-4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(3-methyl-4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane (CID 158094684) is bis([4-(3,4-dimethylphenyl)-2-methylphenyl]phosphane);[4-(3,4-dimethylphenyl)-3-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-2-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-3-methylphenyl]phosphane;[4-(2,4-dimethylphenyl)phenyl]phosphane;[4-(3,4-dimethylphenyl)phenyl]phosphane;[2-methyl-4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(3-methyl-4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane.
What is the SMILES notation for bis([4-(3,4-dimethylphenyl)-2-methylphenyl]phosphane);[4-(3,4-dimethylphenyl)-3-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-2-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-3-methylphenyl]phosphane;[4-(2,4-dimethylphenyl)phenyl]phosphane;[4-(3,4-dimethylphenyl)phenyl]phosphane;[2-methyl-4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(3-methyl-4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane?
The canonical SMILES for bis([4-(3,4-dimethylphenyl)-2-methylphenyl]phosphane);[4-(3,4-dimethylphenyl)-3-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-2-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-3-methylphenyl]phosphane;[4-(2,4-dimethylphenyl)phenyl]phosphane;[4-(3,4-dimethylphenyl)phenyl]phosphane;[2-methyl-4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(3-methyl-4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane is Cc1cc(-c2ccc(-c3ccc(P)c(C)c3)cc2)ccc1P.Cc1cc(-c2ccc(-c3ccc(P)cc3)cc2)ccc1P.Cc1cc(-c2ccc(-c3ccc(P)cc3)cc2C)ccc1P.Cc1cc(-c2ccc(P)cc2)ccc1-c1ccc(P)cc1.Cc1cc(C)cc(-c2ccc(P)c(C)c2)c1.Cc1cc(C)cc(-c2ccc(P)cc2C)c1.Cc1ccc(-c2ccc(P)c(C)c2)cc1C.Cc1ccc(-c2ccc(P)c(C)c2)cc1C.Cc1ccc(-c2ccc(P)cc2)c(C)c1.Cc1ccc(-c2ccc(P)cc2)cc1C.Cc1ccc(-c2ccc(P)cc2C)cc1C.
What is the InChIKey of bis([4-(3,4-dimethylphenyl)-2-methylphenyl]phosphane);[4-(3,4-dimethylphenyl)-3-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-2-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-3-methylphenyl]phosphane;[4-(2,4-dimethylphenyl)phenyl]phosphane;[4-(3,4-dimethylphenyl)phenyl]phosphane;[2-methyl-4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(3-methyl-4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane?
The InChIKey is FONHWZHZBIOUGV-UHFFFAOYSA-N. The full InChI is InChI=1S/2C20H20P2.2C19H18P2.5C15H17P.2C14H15P/c1-13-11-16(15-3-7-18(21)8-4-15)5-9-19(13)17-6-10-20(22)14(2)12-17;1-13-11-17(7-9-19(13)21)15-3-5-16(6-4-15)18-8-10-20(22)14(2)12-18;1-13-12-16(14-2-7-17(20)8-3-14)6-11-19(13)15-4-9-18(21)10-5-15;1-13-12-17(8-11-19(13)21)16-4-2-14(3-5-16)15-6-9-18(20)10-7-15;1-10-6-11(2)8-13(7-10)15-5-4-14(16)9-12(15)3;1-10-6-11(2)8-14(7-10)13-4-5-15(16)12(3)9-13;1-10-4-5-13(8-11(10)2)15-7-6-14(16)9-12(15)3;2*1-10-4-5-13(8-11(10)2)14-6-7-15(16)12(3)9-14;1-10-3-8-14(11(2)9-10)12-4-6-13(15)7-5-12;1-10-3-4-13(9-11(10)2)12-5-7-14(15)8-6-12/h2*3-12H,21-22H2,1-2H3;2*2-12H,20-21H2,1H3;5*4-9H,16H2,1-3H3;2*3-9H,15H2,1-2H3.
What are the key properties of bis([4-(3,4-dimethylphenyl)-2-methylphenyl]phosphane);[4-(3,4-dimethylphenyl)-3-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-2-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-3-methylphenyl]phosphane;[4-(2,4-dimethylphenyl)phenyl]phosphane;[4-(3,4-dimethylphenyl)phenyl]phosphane;[2-methyl-4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(3-methyl-4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane?
bis([4-(3,4-dimethylphenyl)-2-methylphenyl]phosphane);[4-(3,4-dimethylphenyl)-3-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-2-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-3-methylphenyl]phosphane;[4-(2,4-dimethylphenyl)phenyl]phosphane;[4-(3,4-dimethylphenyl)phenyl]phosphane;[2-methyl-4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(3-methyl-4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane has a molecular weight of 2831.13 g/mol, XLogP of 43.77, 15 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis([4-(3,4-dimethylphenyl)-2-methylphenyl]phosphane);[4-(3,4-dimethylphenyl)-3-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-2-methylphenyl]phosphane;[4-(3,5-dimethylphenyl)-3-methylphenyl]phosphane;[4-(2,4-dimethylphenyl)phenyl]phosphane;[4-(3,4-dimethylphenyl)phenyl]phosphane;[2-methyl-4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(3-methyl-4-phosphanylphenyl)phenyl]phenyl]phosphane;[2-methyl-4-[4-(4-phosphanylphenyl)phenyl]phenyl]phosphane;[4-[2-methyl-4-(4-phosphanylphenyl)phenyl]phenyl]phosphane is sourced from PubChem (CID 158094684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).