2-methylpropane-1,1-diol;trichlororhodium

C4H10Cl3O2Rh — CID 175510243

IUPAC2-methylpropane-1,1-diol;trichlororhodium
SMILESCC(C)C(O)O.Cl[Rh](Cl)Cl
InChIInChI=1S/C4H10O2.3ClH.Rh/c1-3(2)4(5)6;;;;/h3-6H,1-2H3;3*1H;/q;;;;+3/p-3
InChIKeyAMYMFOPNSFNDAV-UHFFFAOYSA-K
MW299.39 g/mol
LogP2.02
Rot. Bonds1

About 2-methylpropane-1,1-diol;trichlororhodium

2-methylpropane-1,1-diol;trichlororhodium (PubChem CID 175510243) has the molecular formula C4H10Cl3O2Rh and a molecular weight of 299.39 g/mol. Its IUPAC name is 2-methylpropane-1,1-diol;trichlororhodium.

Molecular Properties

Compound Name2-methylpropane-1,1-diol;trichlororhodium
PubChem CID175510243
Molecular FormulaC4H10Cl3O2Rh
Molecular Weight299.39 g/mol
Exact Mass297.88
IUPAC Name2-methylpropane-1,1-diol;trichlororhodium
SMILESCC(C)C(O)O.Cl[Rh](Cl)Cl
InChIInChI=1S/C4H10O2.3ClH.Rh/c1-3(2)4(5)6;;;;/h3-6H,1-2H3;3*1H;/q;;;;+3/p-3
InChIKeyAMYMFOPNSFNDAV-UHFFFAOYSA-K
XLogP2.02
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.39
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2-methylpropane-1,1-diol;trichlororhodium?
The IUPAC name of 2-methylpropane-1,1-diol;trichlororhodium (CID 175510243) is 2-methylpropane-1,1-diol;trichlororhodium.
What is the SMILES notation for 2-methylpropane-1,1-diol;trichlororhodium?
The canonical SMILES for 2-methylpropane-1,1-diol;trichlororhodium is CC(C)C(O)O.Cl[Rh](Cl)Cl.
What is the InChIKey of 2-methylpropane-1,1-diol;trichlororhodium?
The InChIKey is AMYMFOPNSFNDAV-UHFFFAOYSA-K. The full InChI is InChI=1S/C4H10O2.3ClH.Rh/c1-3(2)4(5)6;;;;/h3-6H,1-2H3;3*1H;/q;;;;+3/p-3.
What are the key properties of 2-methylpropane-1,1-diol;trichlororhodium?
2-methylpropane-1,1-diol;trichlororhodium has a molecular weight of 299.39 g/mol, XLogP of 2.02, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpropane-1,1-diol;trichlororhodium is sourced from PubChem (CID 175510243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).