bis(tert-butylimino)-chlororhenium

C8H18ClN2Re — CID 156687700

IUPACbis(tert-butylimino)-chlororhenium
SMILESCC(C)(C)/N=[Re](\Cl)=N\C(C)(C)C
InChIInChI=1S/2C4H9N.ClH.Re/c2*1-4(2,3)5;;/h2*1-3H3;1H;/q;;;+1/p-1
InChIKeyWQCXSWLMFXOHAL-UHFFFAOYSA-M
MW363.91 g/mol
LogP3.72
Rot. Bonds

About bis(tert-butylimino)-chlororhenium

bis(tert-butylimino)-chlororhenium (PubChem CID 156687700) has the molecular formula C8H18ClN2Re and a molecular weight of 363.91 g/mol. Its IUPAC name is bis(tert-butylimino)-chlororhenium.

Molecular Properties

Compound Namebis(tert-butylimino)-chlororhenium
PubChem CID156687700
Molecular FormulaC8H18ClN2Re
Molecular Weight363.91 g/mol
Exact Mass364.07
IUPAC Namebis(tert-butylimino)-chlororhenium
SMILESCC(C)(C)/N=[Re](\Cl)=N\C(C)(C)C
InChIInChI=1S/2C4H9N.ClH.Re/c2*1-4(2,3)5;;/h2*1-3H3;1H;/q;;;+1/p-1
InChIKeyWQCXSWLMFXOHAL-UHFFFAOYSA-M
XLogP3.72
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.91
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of bis(tert-butylimino)-chlororhenium?
The IUPAC name of bis(tert-butylimino)-chlororhenium (CID 156687700) is bis(tert-butylimino)-chlororhenium.
What is the SMILES notation for bis(tert-butylimino)-chlororhenium?
The canonical SMILES for bis(tert-butylimino)-chlororhenium is CC(C)(C)/N=[Re](\Cl)=N\C(C)(C)C.
What is the InChIKey of bis(tert-butylimino)-chlororhenium?
The InChIKey is WQCXSWLMFXOHAL-UHFFFAOYSA-M. The full InChI is InChI=1S/2C4H9N.ClH.Re/c2*1-4(2,3)5;;/h2*1-3H3;1H;/q;;;+1/p-1.
What are the key properties of bis(tert-butylimino)-chlororhenium?
bis(tert-butylimino)-chlororhenium has a molecular weight of 363.91 g/mol, XLogP of 3.72, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(tert-butylimino)-chlororhenium is sourced from PubChem (CID 156687700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).