[2-[[2-di(propan-2-yl)phosphanylphenyl]-(2-methoxyphenyl)methyl]phenyl]-di(propan-2-yl)phosphane

C32H44OP2 — CID 139112665

IUPAC[2-[[2-di(propan-2-yl)phosphanylphenyl]-(2-methoxyphenyl)methyl]phenyl]-di(propan-2-yl)phosphane
SMILESCOc1ccccc1C(c1ccccc1P(C(C)C)C(C)C)c1ccccc1P(C(C)C)C(C)C
InChIInChI=1S/C32H44OP2/c1-22(2)34(23(3)4)30-20-14-11-17-27(30)32(26-16-10-13-19-29(26)33-9)28-18-12-15-21-31(28)35(24(5)6)25(7)8/h10-25,32H,1-9H3
InChIKeyUEANUSMYQIZZAS-UHFFFAOYSA-N
MW506.65 g/mol
LogP8.72
Rot. Bonds10

About [2-[[2-di(propan-2-yl)phosphanylphenyl]-(2-methoxyphenyl)methyl]phenyl]-di(propan-2-yl)phosphane

[2-[[2-di(propan-2-yl)phosphanylphenyl]-(2-methoxyphenyl)methyl]phenyl]-di(propan-2-yl)phosphane (PubChem CID 139112665) has the molecular formula C32H44OP2 and a molecular weight of 506.65 g/mol. Its IUPAC name is [2-[[2-di(propan-2-yl)phosphanylphenyl]-(2-methoxyphenyl)methyl]phenyl]-di(propan-2-yl)phosphane.

Molecular Properties

Compound Name[2-[[2-di(propan-2-yl)phosphanylphenyl]-(2-methoxyphenyl)methyl]phenyl]-di(propan-2-yl)phosphane
PubChem CID139112665
Molecular FormulaC32H44OP2
Molecular Weight506.65 g/mol
Exact Mass506.29
IUPAC Name[2-[[2-di(propan-2-yl)phosphanylphenyl]-(2-methoxyphenyl)methyl]phenyl]-di(propan-2-yl)phosphane
SMILESCOc1ccccc1C(c1ccccc1P(C(C)C)C(C)C)c1ccccc1P(C(C)C)C(C)C
InChIInChI=1S/C32H44OP2/c1-22(2)34(23(3)4)30-20-14-11-17-27(30)32(26-16-10-13-19-29(26)33-9)28-18-12-15-21-31(28)35(24(5)6)25(7)8/h10-25,32H,1-9H3
InChIKeyUEANUSMYQIZZAS-UHFFFAOYSA-N
XLogP8.72
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms35
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500506.65
LogP ≤ 58.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

ethane;1-methoxy-2-propan-2-ylbenzene
CID 144548142
ethane;1-methoxy-2-propan-2-ylbenzene
CID 142030907
1-(3-chlorobutan-2-yl)-2-methoxybenzene
CID 66470656
1-methoxy-2-[(1R)-1-propan-2-yloxyethyl]benzene
CID 10750337
1-(3-bromobutan-2-yl)-2-methoxybenzene
CID 66469864
1-methoxy-4-[(4-methoxy-2,3-dimethylphenyl)-(2-methoxyphenyl)methyl]-2,3-dimethylbenzene
CID 58297984
[(1S)-1-(2-methoxyphenyl)ethyl]phosphane
CID 130462203
1-[bis(2-ethoxyphenyl)methyl]-2-ethoxybenzene
CID 173071394
(1S)-1-(2-methoxyphenyl)ethanethiol
CID 28974918
1-(1,2-diiodoethyl)-2-methoxybenzene
CID 174309345
(1R)-1-(2-methoxyphenyl)-N-[(1R)-1-(2-methoxyphenyl)ethyl]ethanamine
CID 11346678
2-(2-methoxyphenyl)-4-methylpentan-3-amine
CID 79299473

Frequently Asked Questions

What is the IUPAC name of [2-[[2-di(propan-2-yl)phosphanylphenyl]-(2-methoxyphenyl)methyl]phenyl]-di(propan-2-yl)phosphane?
The IUPAC name of [2-[[2-di(propan-2-yl)phosphanylphenyl]-(2-methoxyphenyl)methyl]phenyl]-di(propan-2-yl)phosphane (CID 139112665) is [2-[[2-di(propan-2-yl)phosphanylphenyl]-(2-methoxyphenyl)methyl]phenyl]-di(propan-2-yl)phosphane.
What is the SMILES notation for [2-[[2-di(propan-2-yl)phosphanylphenyl]-(2-methoxyphenyl)methyl]phenyl]-di(propan-2-yl)phosphane?
The canonical SMILES for [2-[[2-di(propan-2-yl)phosphanylphenyl]-(2-methoxyphenyl)methyl]phenyl]-di(propan-2-yl)phosphane is COc1ccccc1C(c1ccccc1P(C(C)C)C(C)C)c1ccccc1P(C(C)C)C(C)C.
What is the InChIKey of [2-[[2-di(propan-2-yl)phosphanylphenyl]-(2-methoxyphenyl)methyl]phenyl]-di(propan-2-yl)phosphane?
The InChIKey is UEANUSMYQIZZAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H44OP2/c1-22(2)34(23(3)4)30-20-14-11-17-27(30)32(26-16-10-13-19-29(26)33-9)28-18-12-15-21-31(28)35(24(5)6)25(7)8/h10-25,32H,1-9H3.
What are the key properties of [2-[[2-di(propan-2-yl)phosphanylphenyl]-(2-methoxyphenyl)methyl]phenyl]-di(propan-2-yl)phosphane?
[2-[[2-di(propan-2-yl)phosphanylphenyl]-(2-methoxyphenyl)methyl]phenyl]-di(propan-2-yl)phosphane has a molecular weight of 506.65 g/mol, XLogP of 8.72, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[2-di(propan-2-yl)phosphanylphenyl]-(2-methoxyphenyl)methyl]phenyl]-di(propan-2-yl)phosphane is sourced from PubChem (CID 139112665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).