neodymium(3+);propan-2-ol;trichloride

C3H8Cl3NdO — CID 172788287

IUPACneodymium(3+);propan-2-ol;trichloride
SMILESCC(C)O.[Cl-].[Cl-].[Cl-].[Nd+3]
InChIInChI=1S/C3H8O.3ClH.Nd/c1-3(2)4;;;;/h3-4H,1-2H3;3*1H;/q;;;;+3/p-3
InChIKeyPFAIXSKVEMXHEN-UHFFFAOYSA-K
MW310.70 g/mol
LogP-8.60
Rot. Bonds

About neodymium(3+);propan-2-ol;trichloride

neodymium(3+);propan-2-ol;trichloride (PubChem CID 172788287) has the molecular formula C3H8Cl3NdO and a molecular weight of 310.70 g/mol. Its IUPAC name is neodymium(3+);propan-2-ol;trichloride.

Molecular Properties

Compound Nameneodymium(3+);propan-2-ol;trichloride
PubChem CID172788287
Molecular FormulaC3H8Cl3NdO
Molecular Weight310.70 g/mol
Exact Mass306.87
IUPAC Nameneodymium(3+);propan-2-ol;trichloride
SMILESCC(C)O.[Cl-].[Cl-].[Cl-].[Nd+3]
InChIInChI=1S/C3H8O.3ClH.Nd/c1-3(2)4;;;;/h3-4H,1-2H3;3*1H;/q;;;;+3/p-3
InChIKeyPFAIXSKVEMXHEN-UHFFFAOYSA-K
XLogP-8.60
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.70
LogP ≤ 5-8.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of neodymium(3+);propan-2-ol;trichloride?
The IUPAC name of neodymium(3+);propan-2-ol;trichloride (CID 172788287) is neodymium(3+);propan-2-ol;trichloride.
What is the SMILES notation for neodymium(3+);propan-2-ol;trichloride?
The canonical SMILES for neodymium(3+);propan-2-ol;trichloride is CC(C)O.[Cl-].[Cl-].[Cl-].[Nd+3].
What is the InChIKey of neodymium(3+);propan-2-ol;trichloride?
The InChIKey is PFAIXSKVEMXHEN-UHFFFAOYSA-K. The full InChI is InChI=1S/C3H8O.3ClH.Nd/c1-3(2)4;;;;/h3-4H,1-2H3;3*1H;/q;;;;+3/p-3.
What are the key properties of neodymium(3+);propan-2-ol;trichloride?
neodymium(3+);propan-2-ol;trichloride has a molecular weight of 310.70 g/mol, XLogP of -8.60, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for neodymium(3+);propan-2-ol;trichloride is sourced from PubChem (CID 172788287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).