3-methyl-1-phenyl-1,4,7-triphosphecane

C14H23P3 — CID 16686339

IUPAC3-methyl-1-phenyl-1,4,7-triphosphecane
SMILESCC1CP(c2ccccc2)CCCPCCP1
InChIInChI=1S/C14H23P3/c1-13-12-17(14-6-3-2-4-7-14)11-5-8-15-9-10-16-13/h2-4,6-7,13,15-16H,5,8-12H2,1H3
InChIKeyMGLWAGOBNJXUKO-UHFFFAOYSA-N
MW284.26 g/mol
LogP3.94
Rot. Bonds1

About 3-methyl-1-phenyl-1,4,7-triphosphecane

3-methyl-1-phenyl-1,4,7-triphosphecane (PubChem CID 16686339) has the molecular formula C14H23P3 and a molecular weight of 284.26 g/mol. Its IUPAC name is 3-methyl-1-phenyl-1,4,7-triphosphecane.

Molecular Properties

Compound Name3-methyl-1-phenyl-1,4,7-triphosphecane
PubChem CID16686339
Molecular FormulaC14H23P3
Molecular Weight284.26 g/mol
Exact Mass284.10
IUPAC Name3-methyl-1-phenyl-1,4,7-triphosphecane
SMILESCC1CP(c2ccccc2)CCCPCCP1
InChIInChI=1S/C14H23P3/c1-13-12-17(14-6-3-2-4-7-14)11-5-8-15-9-10-16-13/h2-4,6-7,13,15-16H,5,8-12H2,1H3
InChIKeyMGLWAGOBNJXUKO-UHFFFAOYSA-N
XLogP3.94
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.26
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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CID 132567195
1,5-diphenyl-1,5-diphosphocane
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3,4-dimethyl-1-phenylphospholane
CID 11732644
CID 11732643
CID 11732643
3,7,11-triphenyl-3,7,11-triphosphabicyclo[11.3.1]heptadeca-1(17),13,15-triene
CID 101434382
chloroplatinum(1+);(8E,23E)-1,16-diphenyl-1,16-diphosphacyclotriaconta-8,23-diene;1,2,3,4,5-pentafluorobenzene-6-ide
CID 11320642
1-methyl-4-phenyl-1,4-azaphosphinane
CID 71365636
trimethyl-(1-phenylphospholan-2-yl)stannane
CID 177488803
trimethyl-[(2R)-1-phenylphospholan-2-yl]stannane
CID 177447932
(2S,3S)-2,3-dimethyl-1-phenylphosphirane
CID 10844752
2,4-dimethyl-1-phenylphosphetane
CID 23418540
1-phenylphosphinane-4-carboxylic acid
CID 143517103

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-phenyl-1,4,7-triphosphecane?
The IUPAC name of 3-methyl-1-phenyl-1,4,7-triphosphecane (CID 16686339) is 3-methyl-1-phenyl-1,4,7-triphosphecane.
What is the SMILES notation for 3-methyl-1-phenyl-1,4,7-triphosphecane?
The canonical SMILES for 3-methyl-1-phenyl-1,4,7-triphosphecane is CC1CP(c2ccccc2)CCCPCCP1.
What is the InChIKey of 3-methyl-1-phenyl-1,4,7-triphosphecane?
The InChIKey is MGLWAGOBNJXUKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23P3/c1-13-12-17(14-6-3-2-4-7-14)11-5-8-15-9-10-16-13/h2-4,6-7,13,15-16H,5,8-12H2,1H3.
What are the key properties of 3-methyl-1-phenyl-1,4,7-triphosphecane?
3-methyl-1-phenyl-1,4,7-triphosphecane has a molecular weight of 284.26 g/mol, XLogP of 3.94, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-phenyl-1,4,7-triphosphecane is sourced from PubChem (CID 16686339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).