CID 158205463

C12H25Rb2 — CID 158205463

IUPAC—
SMILESC=CC.C=CC.C=CC.[CH2-]CC.[Rb+].[Rb]
InChIInChI=1S/C3H7.3C3H6.2Rb/c4*1-3-2;;/h1,3H2,2H3;3*3H,1H2,2H3;;/q-1;;;;;+1
InChIKeyKCRVMXNDSPLBBT-UHFFFAOYSA-N
MW340.27 g/mol
LogP1.43
Rot. Bonds

About CID 158205463

CID 158205463 (PubChem CID 158205463) has the molecular formula C12H25Rb2 and a molecular weight of 340.27 g/mol.

Molecular Properties

Compound NameCID 158205463
PubChem CID158205463
Molecular FormulaC12H25Rb2
Molecular Weight340.27 g/mol
Exact Mass339.02
IUPAC Name—
SMILESC=CC.C=CC.C=CC.[CH2-]CC.[Rb+].[Rb]
InChIInChI=1S/C3H7.3C3H6.2Rb/c4*1-3-2;;/h1,3H2,2H3;3*3H,1H2,2H3;;/q-1;;;;;+1
InChIKeyKCRVMXNDSPLBBT-UHFFFAOYSA-N
XLogP1.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.27
LogP ≤ 51.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

ethane;hydride;methane;propane;prop-1-ene;tetrakis(rubidium(1+))
CID 158842946
prop-1-ene
CID 162178440
ethylphosphane;prop-1-ene
CID 91599859
ethanamine;prop-1-ene
CID 142862814
butane;ethane;propane;prop-1-ene
CID 143366707
butane;ethane;ethene;prop-1-ene
CID 144524801
CID 171377879
CID 171377879
ethene;tetrakis(prop-1-ene)
CID 158667737
ethane;tetrakis(prop-1-ene)
CID 90918926
silver propane
CID 18629779
λ2-plumbane;prop-1-ene
CID 173103273
propane;uranium
CID 58593144

Frequently Asked Questions

What is the IUPAC name of CID 158205463?
The IUPAC name of CID 158205463 (CID 158205463) is not available.
What is the SMILES notation for CID 158205463?
The canonical SMILES for CID 158205463 is C=CC.C=CC.C=CC.[CH2-]CC.[Rb+].[Rb].
What is the InChIKey of CID 158205463?
The InChIKey is KCRVMXNDSPLBBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7.3C3H6.2Rb/c4*1-3-2;;/h1,3H2,2H3;3*3H,1H2,2H3;;/q-1;;;;;+1.
What are the key properties of CID 158205463?
CID 158205463 has a molecular weight of 340.27 g/mol, XLogP of 1.43, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 158205463 is sourced from PubChem (CID 158205463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).