ethane;ethyl(phenyl)phosphane;neodymium

C10H16NdP- — CID 87739299

IUPACethane;ethyl(phenyl)phosphane;neodymium
SMILESCCPc1ccccc1.[CH2-]C.[Nd]
InChIInChI=1S/C8H11P.C2H5.Nd/c1-2-9-8-6-4-3-5-7-8;1-2;/h3-7,9H,2H2,1H3;1H2,2H3;/q;-1;
InChIKeySTSZCHLBJMROQR-UHFFFAOYSA-N
MW311.45 g/mol
LogP2.85
Rot. Bonds2

About ethane;ethyl(phenyl)phosphane;neodymium

ethane;ethyl(phenyl)phosphane;neodymium (PubChem CID 87739299) has the molecular formula C10H16NdP- and a molecular weight of 311.45 g/mol. Its IUPAC name is ethane;ethyl(phenyl)phosphane;neodymium.

Molecular Properties

Compound Nameethane;ethyl(phenyl)phosphane;neodymium
PubChem CID87739299
Molecular FormulaC10H16NdP-
Molecular Weight311.45 g/mol
Exact Mass309.01
IUPAC Nameethane;ethyl(phenyl)phosphane;neodymium
SMILESCCPc1ccccc1.[CH2-]C.[Nd]
InChIInChI=1S/C8H11P.C2H5.Nd/c1-2-9-8-6-4-3-5-7-8;1-2;/h3-7,9H,2H2,1H3;1H2,2H3;/q;-1;
InChIKeySTSZCHLBJMROQR-UHFFFAOYSA-N
XLogP2.85
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.45
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

4-ethylphosphanylaniline
CID 174797902
hexadecyl(phenyl)phosphane
CID 23361411
nonyl(phenyl)phosphane
CID 69424973
(2,2-dimethyl-3-phenylphosphanylpropyl)-phenylphosphane
CID 87575767
methylsilylmethyl(phenyl)phosphane
CID 175226266
hexyl(phenyl)phosphane;dihydrochloride
CID 175399433
bis(diphenylphosphane);ethanol
CID 175242741
diphenylphosphane;ethylphosphane
CID 158116406
CID 16688772
CID 16688772
butane;phenylphosphinous acid
CID 70542931
palladium(2+);phenyl(3-phenylphosphanylpropyl)phosphane;dibromide
CID 18446087
ethyl-(2-phenylphosphanylethyl)-sulfanylidenephosphanium
CID 23566001

Frequently Asked Questions

What is the IUPAC name of ethane;ethyl(phenyl)phosphane;neodymium?
The IUPAC name of ethane;ethyl(phenyl)phosphane;neodymium (CID 87739299) is ethane;ethyl(phenyl)phosphane;neodymium.
What is the SMILES notation for ethane;ethyl(phenyl)phosphane;neodymium?
The canonical SMILES for ethane;ethyl(phenyl)phosphane;neodymium is CCPc1ccccc1.[CH2-]C.[Nd].
What is the InChIKey of ethane;ethyl(phenyl)phosphane;neodymium?
The InChIKey is STSZCHLBJMROQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11P.C2H5.Nd/c1-2-9-8-6-4-3-5-7-8;1-2;/h3-7,9H,2H2,1H3;1H2,2H3;/q;-1;.
What are the key properties of ethane;ethyl(phenyl)phosphane;neodymium?
ethane;ethyl(phenyl)phosphane;neodymium has a molecular weight of 311.45 g/mol, XLogP of 2.85, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;ethyl(phenyl)phosphane;neodymium is sourced from PubChem (CID 87739299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).