methyl(5,6,7,8-tetrahydronaphthalen-1-yl)phosphane

C11H15P — CID 170002803

IUPACmethyl(5,6,7,8-tetrahydronaphthalen-1-yl)phosphane
SMILESCPc1cccc2c1CCCC2
InChIInChI=1S/C11H15P/c1-12-11-8-4-6-9-5-2-3-7-10(9)11/h4,6,8,12H,2-3,5,7H2,1H3
InChIKeyJSNWIOUXSVPEGF-UHFFFAOYSA-N
MW178.22 g/mol
LogP2.50
Rot. Bonds1

About methyl(5,6,7,8-tetrahydronaphthalen-1-yl)phosphane

methyl(5,6,7,8-tetrahydronaphthalen-1-yl)phosphane (PubChem CID 170002803) has the molecular formula C11H15P and a molecular weight of 178.22 g/mol. Its IUPAC name is methyl(5,6,7,8-tetrahydronaphthalen-1-yl)phosphane.

Molecular Properties

Compound Namemethyl(5,6,7,8-tetrahydronaphthalen-1-yl)phosphane
PubChem CID170002803
Molecular FormulaC11H15P
Molecular Weight178.22 g/mol
Exact Mass178.09
IUPAC Namemethyl(5,6,7,8-tetrahydronaphthalen-1-yl)phosphane
SMILESCPc1cccc2c1CCCC2
InChIInChI=1S/C11H15P/c1-12-11-8-4-6-9-5-2-3-7-10(9)11/h4,6,8,12H,2-3,5,7H2,1H3
InChIKeyJSNWIOUXSVPEGF-UHFFFAOYSA-N
XLogP2.50
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.22
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methyl(5,6,7,8-tetrahydronaphthalen-1-yl)phosphane?
The IUPAC name of methyl(5,6,7,8-tetrahydronaphthalen-1-yl)phosphane (CID 170002803) is methyl(5,6,7,8-tetrahydronaphthalen-1-yl)phosphane.
What is the SMILES notation for methyl(5,6,7,8-tetrahydronaphthalen-1-yl)phosphane?
The canonical SMILES for methyl(5,6,7,8-tetrahydronaphthalen-1-yl)phosphane is CPc1cccc2c1CCCC2.
What is the InChIKey of methyl(5,6,7,8-tetrahydronaphthalen-1-yl)phosphane?
The InChIKey is JSNWIOUXSVPEGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15P/c1-12-11-8-4-6-9-5-2-3-7-10(9)11/h4,6,8,12H,2-3,5,7H2,1H3.
What are the key properties of methyl(5,6,7,8-tetrahydronaphthalen-1-yl)phosphane?
methyl(5,6,7,8-tetrahydronaphthalen-1-yl)phosphane has a molecular weight of 178.22 g/mol, XLogP of 2.50, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methyl(5,6,7,8-tetrahydronaphthalen-1-yl)phosphane is sourced from PubChem (CID 170002803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).