(2,6-dichlorocyclohexa-2,4-dien-1-yl)-trimethylsilylmethanimine

C10H15Cl2NSi — CID 91591121

IUPAC(2,6-dichlorocyclohexa-2,4-dien-1-yl)-trimethylsilylmethanimine
SMILES[H]/N=C(/C1C(Cl)=CC=CC1Cl)[Si](C)(C)C
InChIInChI=1S/C10H15Cl2NSi/c1-14(2,3)10(13)9-7(11)5-4-6-8(9)12/h4-7,9,13H,1-3H3/b13-10-
InChIKeyOFURETNURXMNNR-RAXLEYEMSA-N
MW248.23 g/mol
LogP3.80
Rot. Bonds2

About (2,6-dichlorocyclohexa-2,4-dien-1-yl)-trimethylsilylmethanimine

(2,6-dichlorocyclohexa-2,4-dien-1-yl)-trimethylsilylmethanimine (PubChem CID 91591121) has the molecular formula C10H15Cl2NSi and a molecular weight of 248.23 g/mol. Its IUPAC name is (2,6-dichlorocyclohexa-2,4-dien-1-yl)-trimethylsilylmethanimine.

Molecular Properties

Compound Name(2,6-dichlorocyclohexa-2,4-dien-1-yl)-trimethylsilylmethanimine
PubChem CID91591121
Molecular FormulaC10H15Cl2NSi
Molecular Weight248.23 g/mol
Exact Mass247.04
IUPAC Name(2,6-dichlorocyclohexa-2,4-dien-1-yl)-trimethylsilylmethanimine
SMILES[H]/N=C(/C1C(Cl)=CC=CC1Cl)[Si](C)(C)C
InChIInChI=1S/C10H15Cl2NSi/c1-14(2,3)10(13)9-7(11)5-4-6-8(9)12/h4-7,9,13H,1-3H3/b13-10-
InChIKeyOFURETNURXMNNR-RAXLEYEMSA-N
XLogP3.80
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.23
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2,6-dichlorocyclohexa-2,4-dien-1-yl)-trimethylsilylmethanimine?
The IUPAC name of (2,6-dichlorocyclohexa-2,4-dien-1-yl)-trimethylsilylmethanimine (CID 91591121) is (2,6-dichlorocyclohexa-2,4-dien-1-yl)-trimethylsilylmethanimine.
What is the SMILES notation for (2,6-dichlorocyclohexa-2,4-dien-1-yl)-trimethylsilylmethanimine?
The canonical SMILES for (2,6-dichlorocyclohexa-2,4-dien-1-yl)-trimethylsilylmethanimine is [H]/N=C(/C1C(Cl)=CC=CC1Cl)[Si](C)(C)C.
What is the InChIKey of (2,6-dichlorocyclohexa-2,4-dien-1-yl)-trimethylsilylmethanimine?
The InChIKey is OFURETNURXMNNR-RAXLEYEMSA-N. The full InChI is InChI=1S/C10H15Cl2NSi/c1-14(2,3)10(13)9-7(11)5-4-6-8(9)12/h4-7,9,13H,1-3H3/b13-10-.
What are the key properties of (2,6-dichlorocyclohexa-2,4-dien-1-yl)-trimethylsilylmethanimine?
(2,6-dichlorocyclohexa-2,4-dien-1-yl)-trimethylsilylmethanimine has a molecular weight of 248.23 g/mol, XLogP of 3.80, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dichlorocyclohexa-2,4-dien-1-yl)-trimethylsilylmethanimine is sourced from PubChem (CID 91591121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).