bis(3,5-dimethylphenyl)phosphane;bis(2-methoxyphenyl)phosphane;bis(4-methylphenyl)phosphane;bis(2,4,6-trimethylphenyl)phosphane

C62H72O2P4 — CID 160804769

IUPACbis(3,5-dimethylphenyl)phosphane;bis(2-methoxyphenyl)phosphane;bis(4-methylphenyl)phosphane;bis(2,4,6-trimethylphenyl)phosphane
SMILESCOc1ccccc1Pc1ccccc1OC.Cc1cc(C)c(Pc2c(C)cc(C)cc2C)c(C)c1.Cc1cc(C)cc(Pc2cc(C)cc(C)c2)c1.Cc1ccc(Pc2ccc(C)cc2)cc1
InChIInChI=1S/C18H23P.C16H19P.C14H15O2P.C14H15P/c1-11-7-13(3)17(14(4)8-11)19-18-15(5)9-12(2)10-16(18)6;1-11-5-12(2)8-15(7-11)17-16-9-13(3)6-14(4)10-16;1-15-11-7-3-5-9-13(11)17-14-10-6-4-8-12(14)16-2;1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14/h7-10,19H,1-6H3;5-10,17H,1-4H3;3-10,17H,1-2H3;3-10,15H,1-2H3
InChIKeySDNRVKPBBGROHP-UHFFFAOYSA-N
MW973.15 g/mol
LogP12.98
Rot. Bonds10

About bis(3,5-dimethylphenyl)phosphane;bis(2-methoxyphenyl)phosphane;bis(4-methylphenyl)phosphane;bis(2,4,6-trimethylphenyl)phosphane

bis(3,5-dimethylphenyl)phosphane;bis(2-methoxyphenyl)phosphane;bis(4-methylphenyl)phosphane;bis(2,4,6-trimethylphenyl)phosphane (PubChem CID 160804769) has the molecular formula C62H72O2P4 and a molecular weight of 973.15 g/mol. Its IUPAC name is bis(3,5-dimethylphenyl)phosphane;bis(2-methoxyphenyl)phosphane;bis(4-methylphenyl)phosphane;bis(2,4,6-trimethylphenyl)phosphane.

Molecular Properties

Compound Namebis(3,5-dimethylphenyl)phosphane;bis(2-methoxyphenyl)phosphane;bis(4-methylphenyl)phosphane;bis(2,4,6-trimethylphenyl)phosphane
PubChem CID160804769
Molecular FormulaC62H72O2P4
Molecular Weight973.15 g/mol
Exact Mass972.45
IUPAC Namebis(3,5-dimethylphenyl)phosphane;bis(2-methoxyphenyl)phosphane;bis(4-methylphenyl)phosphane;bis(2,4,6-trimethylphenyl)phosphane
SMILESCOc1ccccc1Pc1ccccc1OC.Cc1cc(C)c(Pc2c(C)cc(C)cc2C)c(C)c1.Cc1cc(C)cc(Pc2cc(C)cc(C)c2)c1.Cc1ccc(Pc2ccc(C)cc2)cc1
InChIInChI=1S/C18H23P.C16H19P.C14H15O2P.C14H15P/c1-11-7-13(3)17(14(4)8-11)19-18-15(5)9-12(2)10-16(18)6;1-11-5-12(2)8-15(7-11)17-16-9-13(3)6-14(4)10-16;1-15-11-7-3-5-9-13(11)17-14-10-6-4-8-12(14)16-2;1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14/h7-10,19H,1-6H3;5-10,17H,1-4H3;3-10,17H,1-2H3;3-10,15H,1-2H3
InChIKeySDNRVKPBBGROHP-UHFFFAOYSA-N
XLogP12.98
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms68
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500973.15
LogP ≤ 512.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

bis(2-methoxyphenyl)phosphane
CID 11679785
(2,3-dimethylphenyl)-(2-methoxyphenyl)phosphane
CID 174776553
(3,5-dimethylphenyl)-phenylphosphane
CID 22961936
lithium;hydride;(2-methoxyphenyl)-phenylphosphane
CID 175008654
(2-methoxyphenyl)phosphanyl-(2,4,6-trimethylphenyl)methanone
CID 174858055
[3,5-bis(trifluoromethyl)phenyl]-(2-methoxyphenyl)phosphane
CID 140618175
(3,5-dimethylphenyl)-[2-[2-[2-(3,5-dimethylphenyl)propan-2-ylphosphanyl]-6-methoxyphenyl]-3-methoxyphenyl]phosphane
CID 142525801
1-methoxy-2,4-dimethyl(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-triene
CID 169444379
(4-methylphenyl)-(2-methyl-4-phenylphenyl)phosphane
CID 118112401
2-[(2-methoxyphenyl)methyl]-1,3,5-trimethylbenzene
CID 160889677
2-methoxyaniline;4-methylaniline
CID 159047028
2-methoxy-N-methyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzamide
CID 27783988

Frequently Asked Questions

What is the IUPAC name of bis(3,5-dimethylphenyl)phosphane;bis(2-methoxyphenyl)phosphane;bis(4-methylphenyl)phosphane;bis(2,4,6-trimethylphenyl)phosphane?
The IUPAC name of bis(3,5-dimethylphenyl)phosphane;bis(2-methoxyphenyl)phosphane;bis(4-methylphenyl)phosphane;bis(2,4,6-trimethylphenyl)phosphane (CID 160804769) is bis(3,5-dimethylphenyl)phosphane;bis(2-methoxyphenyl)phosphane;bis(4-methylphenyl)phosphane;bis(2,4,6-trimethylphenyl)phosphane.
What is the SMILES notation for bis(3,5-dimethylphenyl)phosphane;bis(2-methoxyphenyl)phosphane;bis(4-methylphenyl)phosphane;bis(2,4,6-trimethylphenyl)phosphane?
The canonical SMILES for bis(3,5-dimethylphenyl)phosphane;bis(2-methoxyphenyl)phosphane;bis(4-methylphenyl)phosphane;bis(2,4,6-trimethylphenyl)phosphane is COc1ccccc1Pc1ccccc1OC.Cc1cc(C)c(Pc2c(C)cc(C)cc2C)c(C)c1.Cc1cc(C)cc(Pc2cc(C)cc(C)c2)c1.Cc1ccc(Pc2ccc(C)cc2)cc1.
What is the InChIKey of bis(3,5-dimethylphenyl)phosphane;bis(2-methoxyphenyl)phosphane;bis(4-methylphenyl)phosphane;bis(2,4,6-trimethylphenyl)phosphane?
The InChIKey is SDNRVKPBBGROHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23P.C16H19P.C14H15O2P.C14H15P/c1-11-7-13(3)17(14(4)8-11)19-18-15(5)9-12(2)10-16(18)6;1-11-5-12(2)8-15(7-11)17-16-9-13(3)6-14(4)10-16;1-15-11-7-3-5-9-13(11)17-14-10-6-4-8-12(14)16-2;1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14/h7-10,19H,1-6H3;5-10,17H,1-4H3;3-10,17H,1-2H3;3-10,15H,1-2H3.
What are the key properties of bis(3,5-dimethylphenyl)phosphane;bis(2-methoxyphenyl)phosphane;bis(4-methylphenyl)phosphane;bis(2,4,6-trimethylphenyl)phosphane?
bis(3,5-dimethylphenyl)phosphane;bis(2-methoxyphenyl)phosphane;bis(4-methylphenyl)phosphane;bis(2,4,6-trimethylphenyl)phosphane has a molecular weight of 973.15 g/mol, XLogP of 12.98, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(3,5-dimethylphenyl)phosphane;bis(2-methoxyphenyl)phosphane;bis(4-methylphenyl)phosphane;bis(2,4,6-trimethylphenyl)phosphane is sourced from PubChem (CID 160804769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).