tert-butyl-cyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-[2-[tert-butyl(cyclohexyl)phosphanyl]phenyl]-N,N-dimethylaniline;tert-butyl-ethyl-(2-phenylphenyl)phosphane;ditert-butyl(naphthalen-1-yl)phosphane;dicyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-(2-dicyclohexylphosphanylphenyl)-N,N-dimethylaniline

C134H182N2O2P6 — CID 158955805

IUPACtert-butyl-cyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-[2-[tert-butyl(cyclohexyl)phosphanyl]phenyl]-N,N-dimethylaniline;tert-butyl-ethyl-(2-phenylphenyl)phosphane;ditert-butyl(naphthalen-1-yl)phosphane;dicyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-(2-dicyclohexylphosphanylphenyl)-N,N-dimethylaniline
SMILESCC(C)(C)P(c1cccc2ccccc12)C(C)(C)C.CCP(c1ccccc1-c1ccccc1)C(C)(C)C.CN(C)c1ccccc1-c1ccccc1P(C1CCCCC1)C(C)(C)C.CN(C)c1ccccc1-c1ccccc1P(C1CCCCC1)C1CCCCC1.COc1ccc(-c2ccccc2P(C2CCCCC2)C(C)(C)C)cc1.COc1ccc(-c2ccccc2P(C2CCCCC2)C2CCCCC2)cc1
InChIInChI=1S/C26H36NP.C25H33OP.C24H34NP.C23H31OP.C18H25P.C18H23P/c1-27(2)25-19-11-9-17-23(25)24-18-10-12-20-26(24)28(21-13-5-3-6-14-21)22-15-7-4-8-16-22;1-26-21-18-16-20(17-19-21)24-14-8-9-15-25(24)27(22-10-4-2-5-11-22)23-12-6-3-7-13-23;1-24(2,3)26(19-13-7-6-8-14-19)23-18-12-10-16-21(23)20-15-9-11-17-22(20)25(4)5;1-23(2,3)25(20-10-6-5-7-11-20)22-13-9-8-12-21(22)18-14-16-19(24-4)17-15-18;1-17(2,3)19(18(4,5)6)16-13-9-11-14-10-7-8-12-15(14)16;1-5-19(18(2,3)4)17-14-10-9-13-16(17)15-11-7-6-8-12-15/h9-12,17-22H,3-8,13-16H2,1-2H3;8-9,14-19,22-23H,2-7,10-13H2,1H3;9-12,15-19H,6-8,13-14H2,1-5H3;8-9,12-17,20H,5-7,10-11H2,1-4H3;7-13H,1-6H3;6-14H,5H2,1-4H3
InChIKeyJLZJOGHBZANIKU-UHFFFAOYSA-N
MW2038.79 g/mol
LogP38.41
Rot. Bonds22

About tert-butyl-cyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-[2-[tert-butyl(cyclohexyl)phosphanyl]phenyl]-N,N-dimethylaniline;tert-butyl-ethyl-(2-phenylphenyl)phosphane;ditert-butyl(naphthalen-1-yl)phosphane;dicyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-(2-dicyclohexylphosphanylphenyl)-N,N-dimethylaniline

tert-butyl-cyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-[2-[tert-butyl(cyclohexyl)phosphanyl]phenyl]-N,N-dimethylaniline;tert-butyl-ethyl-(2-phenylphenyl)phosphane;ditert-butyl(naphthalen-1-yl)phosphane;dicyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-(2-dicyclohexylphosphanylphenyl)-N,N-dimethylaniline (PubChem CID 158955805) has the molecular formula C134H182N2O2P6 and a molecular weight of 2038.79 g/mol. Its IUPAC name is tert-butyl-cyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-[2-[tert-butyl(cyclohexyl)phosphanyl]phenyl]-N,N-dimethylaniline;tert-butyl-ethyl-(2-phenylphenyl)phosphane;ditert-butyl(naphthalen-1-yl)phosphane;dicyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-(2-dicyclohexylphosphanylphenyl)-N,N-dimethylaniline.

Molecular Properties

Compound Nametert-butyl-cyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-[2-[tert-butyl(cyclohexyl)phosphanyl]phenyl]-N,N-dimethylaniline;tert-butyl-ethyl-(2-phenylphenyl)phosphane;ditert-butyl(naphthalen-1-yl)phosphane;dicyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-(2-dicyclohexylphosphanylphenyl)-N,N-dimethylaniline
PubChem CID158955805
Molecular FormulaC134H182N2O2P6
Molecular Weight2038.79 g/mol
Exact Mass2037.26
IUPAC Nametert-butyl-cyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-[2-[tert-butyl(cyclohexyl)phosphanyl]phenyl]-N,N-dimethylaniline;tert-butyl-ethyl-(2-phenylphenyl)phosphane;ditert-butyl(naphthalen-1-yl)phosphane;dicyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-(2-dicyclohexylphosphanylphenyl)-N,N-dimethylaniline
SMILESCC(C)(C)P(c1cccc2ccccc12)C(C)(C)C.CCP(c1ccccc1-c1ccccc1)C(C)(C)C.CN(C)c1ccccc1-c1ccccc1P(C1CCCCC1)C(C)(C)C.CN(C)c1ccccc1-c1ccccc1P(C1CCCCC1)C1CCCCC1.COc1ccc(-c2ccccc2P(C2CCCCC2)C(C)(C)C)cc1.COc1ccc(-c2ccccc2P(C2CCCCC2)C2CCCCC2)cc1
InChIInChI=1S/C26H36NP.C25H33OP.C24H34NP.C23H31OP.C18H25P.C18H23P/c1-27(2)25-19-11-9-17-23(25)24-18-10-12-20-26(24)28(21-13-5-3-6-14-21)22-15-7-4-8-16-22;1-26-21-18-16-20(17-19-21)24-14-8-9-15-25(24)27(22-10-4-2-5-11-22)23-12-6-3-7-13-23;1-24(2,3)26(19-13-7-6-8-14-19)23-18-12-10-16-21(23)20-15-9-11-17-22(20)25(4)5;1-23(2,3)25(20-10-6-5-7-11-20)22-13-9-8-12-21(22)18-14-16-19(24-4)17-15-18;1-17(2,3)19(18(4,5)6)16-13-9-11-14-10-7-8-12-15(14)16;1-5-19(18(2,3)4)17-14-10-9-13-16(17)15-11-7-6-8-12-15/h9-12,17-22H,3-8,13-16H2,1-2H3;8-9,14-19,22-23H,2-7,10-13H2,1H3;9-12,15-19H,6-8,13-14H2,1-5H3;8-9,12-17,20H,5-7,10-11H2,1-4H3;7-13H,1-6H3;6-14H,5H2,1-4H3
InChIKeyJLZJOGHBZANIKU-UHFFFAOYSA-N
XLogP38.41
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds22
Heavy Atoms144
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002038.79
LogP ≤ 538.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze tert-butyl-cyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-[2-[tert-butyl(cyclohexyl)phosphanyl]phenyl]-N,N-dimethylaniline;tert-butyl-ethyl-(2-phenylphenyl)phosphane;ditert-butyl(naphthalen-1-yl)phosphane;dicyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-(2-dicyclohexylphosphanylphenyl)-N,N-dimethylaniline with MolForge

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Frequently Asked Questions

What is the IUPAC name of tert-butyl-cyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-[2-[tert-butyl(cyclohexyl)phosphanyl]phenyl]-N,N-dimethylaniline;tert-butyl-ethyl-(2-phenylphenyl)phosphane;ditert-butyl(naphthalen-1-yl)phosphane;dicyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-(2-dicyclohexylphosphanylphenyl)-N,N-dimethylaniline?
The IUPAC name of tert-butyl-cyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-[2-[tert-butyl(cyclohexyl)phosphanyl]phenyl]-N,N-dimethylaniline;tert-butyl-ethyl-(2-phenylphenyl)phosphane;ditert-butyl(naphthalen-1-yl)phosphane;dicyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-(2-dicyclohexylphosphanylphenyl)-N,N-dimethylaniline (CID 158955805) is tert-butyl-cyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-[2-[tert-butyl(cyclohexyl)phosphanyl]phenyl]-N,N-dimethylaniline;tert-butyl-ethyl-(2-phenylphenyl)phosphane;ditert-butyl(naphthalen-1-yl)phosphane;dicyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-(2-dicyclohexylphosphanylphenyl)-N,N-dimethylaniline.
What is the SMILES notation for tert-butyl-cyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-[2-[tert-butyl(cyclohexyl)phosphanyl]phenyl]-N,N-dimethylaniline;tert-butyl-ethyl-(2-phenylphenyl)phosphane;ditert-butyl(naphthalen-1-yl)phosphane;dicyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-(2-dicyclohexylphosphanylphenyl)-N,N-dimethylaniline?
The canonical SMILES for tert-butyl-cyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-[2-[tert-butyl(cyclohexyl)phosphanyl]phenyl]-N,N-dimethylaniline;tert-butyl-ethyl-(2-phenylphenyl)phosphane;ditert-butyl(naphthalen-1-yl)phosphane;dicyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-(2-dicyclohexylphosphanylphenyl)-N,N-dimethylaniline is CC(C)(C)P(c1cccc2ccccc12)C(C)(C)C.CCP(c1ccccc1-c1ccccc1)C(C)(C)C.CN(C)c1ccccc1-c1ccccc1P(C1CCCCC1)C(C)(C)C.CN(C)c1ccccc1-c1ccccc1P(C1CCCCC1)C1CCCCC1.COc1ccc(-c2ccccc2P(C2CCCCC2)C(C)(C)C)cc1.COc1ccc(-c2ccccc2P(C2CCCCC2)C2CCCCC2)cc1.
What is the InChIKey of tert-butyl-cyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-[2-[tert-butyl(cyclohexyl)phosphanyl]phenyl]-N,N-dimethylaniline;tert-butyl-ethyl-(2-phenylphenyl)phosphane;ditert-butyl(naphthalen-1-yl)phosphane;dicyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-(2-dicyclohexylphosphanylphenyl)-N,N-dimethylaniline?
The InChIKey is JLZJOGHBZANIKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H36NP.C25H33OP.C24H34NP.C23H31OP.C18H25P.C18H23P/c1-27(2)25-19-11-9-17-23(25)24-18-10-12-20-26(24)28(21-13-5-3-6-14-21)22-15-7-4-8-16-22;1-26-21-18-16-20(17-19-21)24-14-8-9-15-25(24)27(22-10-4-2-5-11-22)23-12-6-3-7-13-23;1-24(2,3)26(19-13-7-6-8-14-19)23-18-12-10-16-21(23)20-15-9-11-17-22(20)25(4)5;1-23(2,3)25(20-10-6-5-7-11-20)22-13-9-8-12-21(22)18-14-16-19(24-4)17-15-18;1-17(2,3)19(18(4,5)6)16-13-9-11-14-10-7-8-12-15(14)16;1-5-19(18(2,3)4)17-14-10-9-13-16(17)15-11-7-6-8-12-15/h9-12,17-22H,3-8,13-16H2,1-2H3;8-9,14-19,22-23H,2-7,10-13H2,1H3;9-12,15-19H,6-8,13-14H2,1-5H3;8-9,12-17,20H,5-7,10-11H2,1-4H3;7-13H,1-6H3;6-14H,5H2,1-4H3.
What are the key properties of tert-butyl-cyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-[2-[tert-butyl(cyclohexyl)phosphanyl]phenyl]-N,N-dimethylaniline;tert-butyl-ethyl-(2-phenylphenyl)phosphane;ditert-butyl(naphthalen-1-yl)phosphane;dicyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-(2-dicyclohexylphosphanylphenyl)-N,N-dimethylaniline?
tert-butyl-cyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-[2-[tert-butyl(cyclohexyl)phosphanyl]phenyl]-N,N-dimethylaniline;tert-butyl-ethyl-(2-phenylphenyl)phosphane;ditert-butyl(naphthalen-1-yl)phosphane;dicyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-(2-dicyclohexylphosphanylphenyl)-N,N-dimethylaniline has a molecular weight of 2038.79 g/mol, XLogP of 38.41, 22 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-cyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-[2-[tert-butyl(cyclohexyl)phosphanyl]phenyl]-N,N-dimethylaniline;tert-butyl-ethyl-(2-phenylphenyl)phosphane;ditert-butyl(naphthalen-1-yl)phosphane;dicyclohexyl-[2-(4-methoxyphenyl)phenyl]phosphane;2-(2-dicyclohexylphosphanylphenyl)-N,N-dimethylaniline is sourced from PubChem (CID 158955805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).