CID 134981237

C11H15O2Rh — CID 134981237

IUPAC—
SMILESC=C.C=C.COC(=O)C1=C[CH]C=C1.[Rh]
InChIInChI=1S/C7H7O2.2C2H4.Rh/c1-9-7(8)6-4-2-3-5-6;2*1-2;/h2-5H,1H3;2*1-2H2;
InChIKeyCRXNEXMOYZMFIH-UHFFFAOYSA-N
MW282.15 g/mol
LogP2.46
Rot. Bonds1

About CID 134981237

CID 134981237 (PubChem CID 134981237) has the molecular formula C11H15O2Rh and a molecular weight of 282.15 g/mol.

Molecular Properties

Compound NameCID 134981237
PubChem CID134981237
Molecular FormulaC11H15O2Rh
Molecular Weight282.15 g/mol
Exact Mass282.01
IUPAC Name—
SMILESC=C.C=C.COC(=O)C1=C[CH]C=C1.[Rh]
InChIInChI=1S/C7H7O2.2C2H4.Rh/c1-9-7(8)6-4-2-3-5-6;2*1-2;/h2-5H,1H3;2*1-2H2;
InChIKeyCRXNEXMOYZMFIH-UHFFFAOYSA-N
XLogP2.46
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.15
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 134981237?
The IUPAC name of CID 134981237 (CID 134981237) is not available.
What is the SMILES notation for CID 134981237?
The canonical SMILES for CID 134981237 is C=C.C=C.COC(=O)C1=C[CH]C=C1.[Rh].
What is the InChIKey of CID 134981237?
The InChIKey is CRXNEXMOYZMFIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7O2.2C2H4.Rh/c1-9-7(8)6-4-2-3-5-6;2*1-2;/h2-5H,1H3;2*1-2H2;.
What are the key properties of CID 134981237?
CID 134981237 has a molecular weight of 282.15 g/mol, XLogP of 2.46, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134981237 is sourced from PubChem (CID 134981237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).