palladium;prop-1-ene;tri(propan-2-yl)phosphane

C12H26PPd- — CID 87969772

IUPACpalladium;prop-1-ene;tri(propan-2-yl)phosphane
SMILESC=C[CH2-].CC(C)P(C(C)C)C(C)C.[Pd]
InChIInChI=1S/C9H21P.C3H5.Pd/c1-7(2)10(8(3)4)9(5)6;1-3-2;/h7-9H,1-6H3;3H,1-2H2;/q;-1;
InChIKeyCTDLZQCWRCJHRE-UHFFFAOYSA-N
MW307.73 g/mol
LogP4.70
Rot. Bonds3

About palladium;prop-1-ene;tri(propan-2-yl)phosphane

palladium;prop-1-ene;tri(propan-2-yl)phosphane (PubChem CID 87969772) has the molecular formula C12H26PPd- and a molecular weight of 307.73 g/mol. Its IUPAC name is palladium;prop-1-ene;tri(propan-2-yl)phosphane.

Molecular Properties

Compound Namepalladium;prop-1-ene;tri(propan-2-yl)phosphane
PubChem CID87969772
Molecular FormulaC12H26PPd-
Molecular Weight307.73 g/mol
Exact Mass307.08
IUPAC Namepalladium;prop-1-ene;tri(propan-2-yl)phosphane
SMILESC=C[CH2-].CC(C)P(C(C)C)C(C)C.[Pd]
InChIInChI=1S/C9H21P.C3H5.Pd/c1-7(2)10(8(3)4)9(5)6;1-3-2;/h7-9H,1-6H3;3H,1-2H2;/q;-1;
InChIKeyCTDLZQCWRCJHRE-UHFFFAOYSA-N
XLogP4.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.73
LogP ≤ 54.70
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

prop-1-ene;titanium(3+)
CID 175904617
palladium(2+);bis(tri(propan-2-yl)phosphane);dibromide
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CID 175123096
chlororuthenium;tris(tri(propan-2-yl)phosphane)
CID 173316351
buta-1,3-diene;2-methylpropane
CID 161376198
carbon monoxide;osmium;bis(tri(propan-2-yl)phosphane)
CID 11444122
dibromonickel;bis(tri(propan-2-yl)phosphane)
CID 88800949
neodymium(3+);prop-1-ene
CID 23088810
2-methylpropane;prop-2-en-1-amine
CID 161130166
ethane;2-methylpropane;prop-1-ene
CID 142053608
2-methanidylpropan-1-one;prop-1-ene;tungsten;uranium(2+)
CID 158408709
2-methanidylprop-1-ene;palladium(2+);tri(propan-2-yl)phosphane;acetate
CID 22335976

Frequently Asked Questions

What is the IUPAC name of palladium;prop-1-ene;tri(propan-2-yl)phosphane?
The IUPAC name of palladium;prop-1-ene;tri(propan-2-yl)phosphane (CID 87969772) is palladium;prop-1-ene;tri(propan-2-yl)phosphane.
What is the SMILES notation for palladium;prop-1-ene;tri(propan-2-yl)phosphane?
The canonical SMILES for palladium;prop-1-ene;tri(propan-2-yl)phosphane is C=C[CH2-].CC(C)P(C(C)C)C(C)C.[Pd].
What is the InChIKey of palladium;prop-1-ene;tri(propan-2-yl)phosphane?
The InChIKey is CTDLZQCWRCJHRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21P.C3H5.Pd/c1-7(2)10(8(3)4)9(5)6;1-3-2;/h7-9H,1-6H3;3H,1-2H2;/q;-1;.
What are the key properties of palladium;prop-1-ene;tri(propan-2-yl)phosphane?
palladium;prop-1-ene;tri(propan-2-yl)phosphane has a molecular weight of 307.73 g/mol, XLogP of 4.70, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for palladium;prop-1-ene;tri(propan-2-yl)phosphane is sourced from PubChem (CID 87969772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).