[2,6-di(propan-2-yl)phenyl]iminotantalum

C12H17NTa — CID 10864957

IUPAC[2,6-di(propan-2-yl)phenyl]iminotantalum
SMILESCC(C)c1cccc(C(C)C)c1N=[Ta]
InChIInChI=1S/C12H17N.Ta/c1-8(2)10-6-5-7-11(9(3)4)12(10)13;/h5-9H,1-4H3;
InChIKeyIIPXUWINBBFION-UHFFFAOYSA-N
MW356.22 g/mol
LogP4.30
Rot. Bonds3

About [2,6-di(propan-2-yl)phenyl]iminotantalum

[2,6-di(propan-2-yl)phenyl]iminotantalum (PubChem CID 10864957) has the molecular formula C12H17NTa and a molecular weight of 356.22 g/mol. Its IUPAC name is [2,6-di(propan-2-yl)phenyl]iminotantalum.

Molecular Properties

Compound Name[2,6-di(propan-2-yl)phenyl]iminotantalum
PubChem CID10864957
Molecular FormulaC12H17NTa
Molecular Weight356.22 g/mol
Exact Mass356.08
IUPAC Name[2,6-di(propan-2-yl)phenyl]iminotantalum
SMILESCC(C)c1cccc(C(C)C)c1N=[Ta]
InChIInChI=1S/C12H17N.Ta/c1-8(2)10-6-5-7-11(9(3)4)12(10)13;/h5-9H,1-4H3;
InChIKeyIIPXUWINBBFION-UHFFFAOYSA-N
XLogP4.30
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.22
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

CID 11767879
CID 11767879
[2,6-di(propan-2-yl)phenyl]iminotitanium(2+)
CID 11564443
N,N'-bis[2,6-di(propan-2-yl)phenyl]ethane-1,2-diimine;cobalt
CID 69498606
N,N'-bis[2,6-di(propan-2-yl)phenyl]ethane-1,2-diimine;carbanide;nickel
CID 21339154
CID 11039200
CID 11039200
N-[2,6-di(propan-2-yl)phenyl]-1-[4-[[2,6-di(propan-2-yl)phenyl]iminomethyl]phenyl]methanimine
CID 2755070
bis[[2,6-di(propan-2-yl)phenyl]imino]-oxorhenium;carbanide
CID 177456396
N-[2,6-di(propan-2-yl)phenyl]ethanimidoyl bromide
CID 132938731
2-N,3-N-bis[2,6-di(propan-2-yl)phenyl]butane-2,3-diimine;carbanide;nickel monohydride
CID 59870067
N,N'-bis[2,6-di(propan-2-yl)phenyl]ethane-1,2-diimine;dibromonickel
CID 21339155
N-(2-methyl-6-propan-2-ylphenyl)propan-2-imine
CID 123174070
N'-[2,6-di(propan-2-yl)phenyl]-N-(2-methyl-6-propan-2-ylphenyl)methanediimine
CID 20719131

Frequently Asked Questions

What is the IUPAC name of [2,6-di(propan-2-yl)phenyl]iminotantalum?
The IUPAC name of [2,6-di(propan-2-yl)phenyl]iminotantalum (CID 10864957) is [2,6-di(propan-2-yl)phenyl]iminotantalum.
What is the SMILES notation for [2,6-di(propan-2-yl)phenyl]iminotantalum?
The canonical SMILES for [2,6-di(propan-2-yl)phenyl]iminotantalum is CC(C)c1cccc(C(C)C)c1N=[Ta].
What is the InChIKey of [2,6-di(propan-2-yl)phenyl]iminotantalum?
The InChIKey is IIPXUWINBBFION-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N.Ta/c1-8(2)10-6-5-7-11(9(3)4)12(10)13;/h5-9H,1-4H3;.
What are the key properties of [2,6-di(propan-2-yl)phenyl]iminotantalum?
[2,6-di(propan-2-yl)phenyl]iminotantalum has a molecular weight of 356.22 g/mol, XLogP of 4.30, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2,6-di(propan-2-yl)phenyl]iminotantalum is sourced from PubChem (CID 10864957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).