(2S,5S)-1-[2-[(2S,5S)-2,5-dimethylphospholan-1-yl]phenyl]-2,5-dimethylphospholane;rhodium;perchlorate

C18H28ClO4P2Rh- — CID 10885700

IUPAC(2S,5S)-1-[2-[(2S,5S)-2,5-dimethylphospholan-1-yl]phenyl]-2,5-dimethylphospholane;rhodium;perchlorate
SMILESC[C@H]1CC[C@H](C)P1c1ccccc1P1[C@@H](C)CC[C@@H]1C.[O-][Cl+3]([O-])([O-])[O-].[Rh]
InChIInChI=1S/C18H28P2.ClHO4.Rh/c1-13-9-10-14(2)19(13)17-7-5-6-8-18(17)20-15(3)11-12-16(20)4;2-1(3,4)5;/h5-8,13-16H,9-12H2,1-4H3;(H,2,3,4,5);/p-1/t13-,14-,15-,16-;;/m0../s1
InChIKeyXETIRLUTHGMIOY-USVCXNFQSA-M
MW508.73 g/mol
LogP0.28
Rot. Bonds2

About (2S,5S)-1-[2-[(2S,5S)-2,5-dimethylphospholan-1-yl]phenyl]-2,5-dimethylphospholane;rhodium;perchlorate

(2S,5S)-1-[2-[(2S,5S)-2,5-dimethylphospholan-1-yl]phenyl]-2,5-dimethylphospholane;rhodium;perchlorate (PubChem CID 10885700) has the molecular formula C18H28ClO4P2Rh- and a molecular weight of 508.73 g/mol. Its IUPAC name is (2S,5S)-1-[2-[(2S,5S)-2,5-dimethylphospholan-1-yl]phenyl]-2,5-dimethylphospholane;rhodium;perchlorate.

Molecular Properties

Compound Name(2S,5S)-1-[2-[(2S,5S)-2,5-dimethylphospholan-1-yl]phenyl]-2,5-dimethylphospholane;rhodium;perchlorate
PubChem CID10885700
Molecular FormulaC18H28ClO4P2Rh-
Molecular Weight508.73 g/mol
Exact Mass508.02
IUPAC Name(2S,5S)-1-[2-[(2S,5S)-2,5-dimethylphospholan-1-yl]phenyl]-2,5-dimethylphospholane;rhodium;perchlorate
SMILESC[C@H]1CC[C@H](C)P1c1ccccc1P1[C@@H](C)CC[C@@H]1C.[O-][Cl+3]([O-])([O-])[O-].[Rh]
InChIInChI=1S/C18H28P2.ClHO4.Rh/c1-13-9-10-14(2)19(13)17-7-5-6-8-18(17)20-15(3)11-12-16(20)4;2-1(3,4)5;/h5-8,13-16H,9-12H2,1-4H3;(H,2,3,4,5);/p-1/t13-,14-,15-,16-;;/m0../s1
InChIKeyXETIRLUTHGMIOY-USVCXNFQSA-M
XLogP0.28
TPSA92.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500508.73
LogP ≤ 50.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

bis(1-[2-(2,5-dimethylphospholan-1-yl)phenyl]-2,5-dimethylphospholane);gold(1+);chloride
CID 23641823
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CID 163355958
(2R,5R)-1-[2-[(2R,5R)-2,5-dimethylphospholan-1-yl]phenyl]-2,5-dimethylphospholane;platinum;(E)-stilbene
CID 10886947
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CID 139306011
dichlororuthenium;bis(N,N-dimethylformamide);(2R,5R)-1-[2-[(2R,5R)-2,5-dimethylphospholan-1-yl]phenyl]-2,5-dimethylphospholane
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CID 162287977
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CID 134991964
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CID 11635863
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CID 172570767
5-[2-(2,6-dimethyl-5-phosphabicyclo[2.1.1]hexan-5-yl)phenyl]-2,6-dimethyl-5-phosphabicyclo[2.1.1]hexane
CID 163609509
(2S,5S)-2,5-dimethyl-7-[2-[(2S)-2-methyl-7-phosphabicyclo[2.2.1]heptan-7-yl]phenyl]-7-phosphabicyclo[2.2.1]heptane
CID 118486235
(2S,4R)-1-[2-[(2S,4S)-2,4-di(propan-2-yl)phosphetan-1-yl]phenyl]-2,4-di(propan-2-yl)phosphetane
CID 51023774

Frequently Asked Questions

What is the IUPAC name of (2S,5S)-1-[2-[(2S,5S)-2,5-dimethylphospholan-1-yl]phenyl]-2,5-dimethylphospholane;rhodium;perchlorate?
The IUPAC name of (2S,5S)-1-[2-[(2S,5S)-2,5-dimethylphospholan-1-yl]phenyl]-2,5-dimethylphospholane;rhodium;perchlorate (CID 10885700) is (2S,5S)-1-[2-[(2S,5S)-2,5-dimethylphospholan-1-yl]phenyl]-2,5-dimethylphospholane;rhodium;perchlorate.
What is the SMILES notation for (2S,5S)-1-[2-[(2S,5S)-2,5-dimethylphospholan-1-yl]phenyl]-2,5-dimethylphospholane;rhodium;perchlorate?
The canonical SMILES for (2S,5S)-1-[2-[(2S,5S)-2,5-dimethylphospholan-1-yl]phenyl]-2,5-dimethylphospholane;rhodium;perchlorate is C[C@H]1CC[C@H](C)P1c1ccccc1P1[C@@H](C)CC[C@@H]1C.[O-][Cl+3]([O-])([O-])[O-].[Rh].
What is the InChIKey of (2S,5S)-1-[2-[(2S,5S)-2,5-dimethylphospholan-1-yl]phenyl]-2,5-dimethylphospholane;rhodium;perchlorate?
The InChIKey is XETIRLUTHGMIOY-USVCXNFQSA-M. The full InChI is InChI=1S/C18H28P2.ClHO4.Rh/c1-13-9-10-14(2)19(13)17-7-5-6-8-18(17)20-15(3)11-12-16(20)4;2-1(3,4)5;/h5-8,13-16H,9-12H2,1-4H3;(H,2,3,4,5);/p-1/t13-,14-,15-,16-;;/m0../s1.
What are the key properties of (2S,5S)-1-[2-[(2S,5S)-2,5-dimethylphospholan-1-yl]phenyl]-2,5-dimethylphospholane;rhodium;perchlorate?
(2S,5S)-1-[2-[(2S,5S)-2,5-dimethylphospholan-1-yl]phenyl]-2,5-dimethylphospholane;rhodium;perchlorate has a molecular weight of 508.73 g/mol, XLogP of 0.28, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,5S)-1-[2-[(2S,5S)-2,5-dimethylphospholan-1-yl]phenyl]-2,5-dimethylphospholane;rhodium;perchlorate is sourced from PubChem (CID 10885700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).