[2,6-bis[2,6-di(propan-2-yl)phenyl]phenyl]imino-dichlorosilane

C30H37Cl2NSi — CID 102266315

IUPAC[2,6-bis[2,6-di(propan-2-yl)phenyl]phenyl]imino-dichlorosilane
SMILESCC(C)c1cccc(C(C)C)c1-c1cccc(-c2c(C(C)C)cccc2C(C)C)c1N=[Si](Cl)Cl
InChIInChI=1S/C30H37Cl2NSi/c1-18(2)22-12-9-13-23(19(3)4)28(22)26-16-11-17-27(30(26)33-34(31)32)29-24(20(5)6)14-10-15-25(29)21(7)8/h9-21H,1-8H3
InChIKeyULPFBXXQFWULCA-UHFFFAOYSA-N
MW510.63 g/mol
LogP10.88
Rot. Bonds7

About [2,6-bis[2,6-di(propan-2-yl)phenyl]phenyl]imino-dichlorosilane

[2,6-bis[2,6-di(propan-2-yl)phenyl]phenyl]imino-dichlorosilane (PubChem CID 102266315) has the molecular formula C30H37Cl2NSi and a molecular weight of 510.63 g/mol. Its IUPAC name is [2,6-bis[2,6-di(propan-2-yl)phenyl]phenyl]imino-dichlorosilane.

Molecular Properties

Compound Name[2,6-bis[2,6-di(propan-2-yl)phenyl]phenyl]imino-dichlorosilane
PubChem CID102266315
Molecular FormulaC30H37Cl2NSi
Molecular Weight510.63 g/mol
Exact Mass509.21
IUPAC Name[2,6-bis[2,6-di(propan-2-yl)phenyl]phenyl]imino-dichlorosilane
SMILESCC(C)c1cccc(C(C)C)c1-c1cccc(-c2c(C(C)C)cccc2C(C)C)c1N=[Si](Cl)Cl
InChIInChI=1S/C30H37Cl2NSi/c1-18(2)22-12-9-13-23(19(3)4)28(22)26-16-11-17-27(30(26)33-34(31)32)29-24(20(5)6)14-10-15-25(29)21(7)8/h9-21H,1-8H3
InChIKeyULPFBXXQFWULCA-UHFFFAOYSA-N
XLogP10.88
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms34
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500510.63
LogP ≤ 510.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

[2,6-bis[2,6-di(propan-2-yl)phenyl]phenyl]phosphane
CID 101430775
CID 162414945
CID 162414945
1,2-diphenyl-3-propan-2-ylbenzene
CID 20568657
CID 136704321
CID 136704321
[2,6-di(propan-2-yl)phenyl]iminotantalum
CID 10864957
bis([2,6-bis[2,6-di(propan-2-yl)phenyl]phenyl]azanide);nickel(2+);toluene
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CID 162409508
CID 162409508
[2,6-di(propan-2-yl)phenyl]iminotitanium(2+)
CID 11564443
2-[[2,6-di(propan-2-yl)phenyl]iminomethyl]-6-[3-[[2,6-di(propan-2-yl)phenyl]iminomethyl]-2-hydroxyphenyl]phenol
CID 135431783
bis([2,6-di(propan-2-yl)phenyl]azanium) dichloride
CID 139074965
1,8-di(propan-2-yl)-9H-fluorene
CID 160592533
bis(1,3-bis[2,6-di(propan-2-yl)phenyl]-2-isocyanobenzene);bis(palladium);bis(prop-1-ene)
CID 139113562

Frequently Asked Questions

What is the IUPAC name of [2,6-bis[2,6-di(propan-2-yl)phenyl]phenyl]imino-dichlorosilane?
The IUPAC name of [2,6-bis[2,6-di(propan-2-yl)phenyl]phenyl]imino-dichlorosilane (CID 102266315) is [2,6-bis[2,6-di(propan-2-yl)phenyl]phenyl]imino-dichlorosilane.
What is the SMILES notation for [2,6-bis[2,6-di(propan-2-yl)phenyl]phenyl]imino-dichlorosilane?
The canonical SMILES for [2,6-bis[2,6-di(propan-2-yl)phenyl]phenyl]imino-dichlorosilane is CC(C)c1cccc(C(C)C)c1-c1cccc(-c2c(C(C)C)cccc2C(C)C)c1N=[Si](Cl)Cl.
What is the InChIKey of [2,6-bis[2,6-di(propan-2-yl)phenyl]phenyl]imino-dichlorosilane?
The InChIKey is ULPFBXXQFWULCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H37Cl2NSi/c1-18(2)22-12-9-13-23(19(3)4)28(22)26-16-11-17-27(30(26)33-34(31)32)29-24(20(5)6)14-10-15-25(29)21(7)8/h9-21H,1-8H3.
What are the key properties of [2,6-bis[2,6-di(propan-2-yl)phenyl]phenyl]imino-dichlorosilane?
[2,6-bis[2,6-di(propan-2-yl)phenyl]phenyl]imino-dichlorosilane has a molecular weight of 510.63 g/mol, XLogP of 10.88, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2,6-bis[2,6-di(propan-2-yl)phenyl]phenyl]imino-dichlorosilane is sourced from PubChem (CID 102266315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).