methane;2-[4-[[4-[[4-(2-phosphanylethyl)cyclohexyl]methyl]cyclohexyl]methyl]cyclohexyl]ethylphosphane;2-[4-[(4-propylcyclohexyl)methyl]cyclohexyl]ethylphosphane

C43H85P3 — CID 159711697

IUPACmethane;2-[4-[[4-[[4-(2-phosphanylethyl)cyclohexyl]methyl]cyclohexyl]methyl]cyclohexyl]ethylphosphane;2-[4-[(4-propylcyclohexyl)methyl]cyclohexyl]ethylphosphane
SMILESC.CCCC1CCC(CC2CCC(CCP)CC2)CC1.PCCC1CCC(CC2CCC(CC3CCC(CCP)CC3)CC2)CC1
InChIInChI=1S/C24H46P2.C18H35P.CH4/c25-15-13-19-1-5-21(6-2-19)17-23-9-11-24(12-10-23)18-22-7-3-20(4-8-22)14-16-26;1-2-3-15-4-8-17(9-5-15)14-18-10-6-16(7-11-18)12-13-19;/h19-24H,1-18,25-26H2;15-18H,2-14,19H2,1H3;1H4
InChIKeyMYXNZQHLANEARS-UHFFFAOYSA-N
MW695.07 g/mol
LogP14.41
Rot. Bonds14

About methane;2-[4-[[4-[[4-(2-phosphanylethyl)cyclohexyl]methyl]cyclohexyl]methyl]cyclohexyl]ethylphosphane;2-[4-[(4-propylcyclohexyl)methyl]cyclohexyl]ethylphosphane

methane;2-[4-[[4-[[4-(2-phosphanylethyl)cyclohexyl]methyl]cyclohexyl]methyl]cyclohexyl]ethylphosphane;2-[4-[(4-propylcyclohexyl)methyl]cyclohexyl]ethylphosphane (PubChem CID 159711697) has the molecular formula C43H85P3 and a molecular weight of 695.07 g/mol. Its IUPAC name is methane;2-[4-[[4-[[4-(2-phosphanylethyl)cyclohexyl]methyl]cyclohexyl]methyl]cyclohexyl]ethylphosphane;2-[4-[(4-propylcyclohexyl)methyl]cyclohexyl]ethylphosphane.

Molecular Properties

Compound Namemethane;2-[4-[[4-[[4-(2-phosphanylethyl)cyclohexyl]methyl]cyclohexyl]methyl]cyclohexyl]ethylphosphane;2-[4-[(4-propylcyclohexyl)methyl]cyclohexyl]ethylphosphane
PubChem CID159711697
Molecular FormulaC43H85P3
Molecular Weight695.07 g/mol
Exact Mass694.59
IUPAC Namemethane;2-[4-[[4-[[4-(2-phosphanylethyl)cyclohexyl]methyl]cyclohexyl]methyl]cyclohexyl]ethylphosphane;2-[4-[(4-propylcyclohexyl)methyl]cyclohexyl]ethylphosphane
SMILESC.CCCC1CCC(CC2CCC(CCP)CC2)CC1.PCCC1CCC(CC2CCC(CC3CCC(CCP)CC3)CC2)CC1
InChIInChI=1S/C24H46P2.C18H35P.CH4/c25-15-13-19-1-5-21(6-2-19)17-23-9-11-24(12-10-23)18-22-7-3-20(4-8-22)14-16-26;1-2-3-15-4-8-17(9-5-15)14-18-10-6-16(7-11-18)12-13-19;/h19-24H,1-18,25-26H2;15-18H,2-14,19H2,1H3;1H4
InChIKeyMYXNZQHLANEARS-UHFFFAOYSA-N
XLogP14.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds14
Heavy Atoms46
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500695.07
LogP ≤ 514.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze methane;2-[4-[[4-[[4-(2-phosphanylethyl)cyclohexyl]methyl]cyclohexyl]methyl]cyclohexyl]ethylphosphane;2-[4-[(4-propylcyclohexyl)methyl]cyclohexyl]ethylphosphane with MolForge

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Related Compounds

ethane;propane;propylcyclopropane
CID 145406182
1,4-dipropylcyclohexane;pentane
CID 90867354
1-ethyl-4-[(4-ethylcyclohexyl)methyl]cyclohexane;1-ethyl-4-[(4-propylcyclohexyl)methyl]cyclohexane;methane;1-propyl-4-[1-(4-propylcyclohexyl)ethenyl]cyclohexane
CID 158374366
1-[(E)-prop-1-enyl]-4-[(4-propylcyclohexyl)methyl]cyclohexane
CID 143761309
methane;1-methyl-4-[[4-[[4-[(4-methylcyclohexyl)methyl]cyclohexyl]methyl]cyclohexyl]methyl]cyclohexane
CID 161317011
methane;1-methyl-4-[[4-[[4-[(4-methylcyclohexyl)methyl]cyclohexyl]methyl]cyclohexyl]methyl]cyclohexane
CID 158911211
1-(2-cyclohexylethyl)-4-[2-(4-propylcyclohexyl)ethyl]cyclohexane
CID 70430254
methylidene-(4-propylcyclohexyl)-λ3-iodane
CID 163994299
propylcyclotetradecane
CID 90991550
1-[(4-ethylcyclohexyl)methyl]-4-[[4-[(4-methylcyclohexyl)methyl]cyclohexyl]methyl]cyclohexane;methane
CID 160789108
1,3,6-trimethyl-9-propylcycloundecane
CID 123524783
1-propyl-4-[2-(4-propylcyclohexyl)ethynyl]cyclohexane
CID 145484566

Frequently Asked Questions

What is the IUPAC name of methane;2-[4-[[4-[[4-(2-phosphanylethyl)cyclohexyl]methyl]cyclohexyl]methyl]cyclohexyl]ethylphosphane;2-[4-[(4-propylcyclohexyl)methyl]cyclohexyl]ethylphosphane?
The IUPAC name of methane;2-[4-[[4-[[4-(2-phosphanylethyl)cyclohexyl]methyl]cyclohexyl]methyl]cyclohexyl]ethylphosphane;2-[4-[(4-propylcyclohexyl)methyl]cyclohexyl]ethylphosphane (CID 159711697) is methane;2-[4-[[4-[[4-(2-phosphanylethyl)cyclohexyl]methyl]cyclohexyl]methyl]cyclohexyl]ethylphosphane;2-[4-[(4-propylcyclohexyl)methyl]cyclohexyl]ethylphosphane.
What is the SMILES notation for methane;2-[4-[[4-[[4-(2-phosphanylethyl)cyclohexyl]methyl]cyclohexyl]methyl]cyclohexyl]ethylphosphane;2-[4-[(4-propylcyclohexyl)methyl]cyclohexyl]ethylphosphane?
The canonical SMILES for methane;2-[4-[[4-[[4-(2-phosphanylethyl)cyclohexyl]methyl]cyclohexyl]methyl]cyclohexyl]ethylphosphane;2-[4-[(4-propylcyclohexyl)methyl]cyclohexyl]ethylphosphane is C.CCCC1CCC(CC2CCC(CCP)CC2)CC1.PCCC1CCC(CC2CCC(CC3CCC(CCP)CC3)CC2)CC1.
What is the InChIKey of methane;2-[4-[[4-[[4-(2-phosphanylethyl)cyclohexyl]methyl]cyclohexyl]methyl]cyclohexyl]ethylphosphane;2-[4-[(4-propylcyclohexyl)methyl]cyclohexyl]ethylphosphane?
The InChIKey is MYXNZQHLANEARS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H46P2.C18H35P.CH4/c25-15-13-19-1-5-21(6-2-19)17-23-9-11-24(12-10-23)18-22-7-3-20(4-8-22)14-16-26;1-2-3-15-4-8-17(9-5-15)14-18-10-6-16(7-11-18)12-13-19;/h19-24H,1-18,25-26H2;15-18H,2-14,19H2,1H3;1H4.
What are the key properties of methane;2-[4-[[4-[[4-(2-phosphanylethyl)cyclohexyl]methyl]cyclohexyl]methyl]cyclohexyl]ethylphosphane;2-[4-[(4-propylcyclohexyl)methyl]cyclohexyl]ethylphosphane?
methane;2-[4-[[4-[[4-(2-phosphanylethyl)cyclohexyl]methyl]cyclohexyl]methyl]cyclohexyl]ethylphosphane;2-[4-[(4-propylcyclohexyl)methyl]cyclohexyl]ethylphosphane has a molecular weight of 695.07 g/mol, XLogP of 14.41, 14 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methane;2-[4-[[4-[[4-(2-phosphanylethyl)cyclohexyl]methyl]cyclohexyl]methyl]cyclohexyl]ethylphosphane;2-[4-[(4-propylcyclohexyl)methyl]cyclohexyl]ethylphosphane is sourced from PubChem (CID 159711697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).