bis(dichloroosmium);bis(1-methyl-4-propan-2-ylbenzene)

C20H28Cl4Os2 — CID 10952856

IUPACbis(dichloroosmium);bis(1-methyl-4-propan-2-ylbenzene)
SMILESCc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.Cl[Os]Cl.Cl[Os]Cl
InChIInChI=1S/2C10H14.4ClH.2Os/c2*1-8(2)10-6-4-9(3)5-7-10;;;;;;/h2*4-8H,1-3H3;4*1H;;/q;;;;;;2*+2/p-4
InChIKeyXIHSXOFUHOTKGH-UHFFFAOYSA-J
MW790.72 g/mol
LogP8.99
Rot. Bonds2

About bis(dichloroosmium);bis(1-methyl-4-propan-2-ylbenzene)

bis(dichloroosmium);bis(1-methyl-4-propan-2-ylbenzene) (PubChem CID 10952856) has the molecular formula C20H28Cl4Os2 and a molecular weight of 790.72 g/mol. Its IUPAC name is bis(dichloroosmium);bis(1-methyl-4-propan-2-ylbenzene).

Molecular Properties

Compound Namebis(dichloroosmium);bis(1-methyl-4-propan-2-ylbenzene)
PubChem CID10952856
Molecular FormulaC20H28Cl4Os2
Molecular Weight790.72 g/mol
Exact Mass792.02
IUPAC Namebis(dichloroosmium);bis(1-methyl-4-propan-2-ylbenzene)
SMILESCc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.Cl[Os]Cl.Cl[Os]Cl
InChIInChI=1S/2C10H14.4ClH.2Os/c2*1-8(2)10-6-4-9(3)5-7-10;;;;;;/h2*4-8H,1-3H3;4*1H;;/q;;;;;;2*+2/p-4
InChIKeyXIHSXOFUHOTKGH-UHFFFAOYSA-J
XLogP8.99
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500790.72
LogP ≤ 58.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

tris(1-methyl-4-propan-2-ylbenzene);dihydrochloride
CID 175503400
bis(chlororuthenium(1+));bis(1-methyl-4-propan-2-ylbenzene);dichloride
CID 11319478
dichlororuthenium;1-methyl-4-propan-2-ylbenzene
CID 11141294
1-methyl-4-propan-2-ylbenzene;ruthenium(2+);dichloride
CID 11551268
1-methyl-4-propan-2-ylbenzene;ruthenium(3+);triiodide
CID 175881712
1-methyl-4-propan-2-ylbenzene;ruthenium;dihydroiodide
CID 175953909
chloro-(4-methylphenyl)-(4-propan-2-ylphenyl)-λ3-iodane
CID 12995384
cumene;ethane;methane;1-methyl-4-propan-2-ylbenzene
CID 159265894
ethane;(4-propan-2-ylphenyl)oxidanium;1,4-xylene
CID 163240911
formic acid;1-methyl-4-propan-2-ylbenzene
CID 145124547
1-(2-chloroethyl)-4-propan-2-ylbenzene;1-methyl-4-propan-2-ylbenzene
CID 159659328
(4-methylphenyl)-(4-propan-2-ylphenyl)iodanium chloride
CID 71349867

Frequently Asked Questions

What is the IUPAC name of bis(dichloroosmium);bis(1-methyl-4-propan-2-ylbenzene)?
The IUPAC name of bis(dichloroosmium);bis(1-methyl-4-propan-2-ylbenzene) (CID 10952856) is bis(dichloroosmium);bis(1-methyl-4-propan-2-ylbenzene).
What is the SMILES notation for bis(dichloroosmium);bis(1-methyl-4-propan-2-ylbenzene)?
The canonical SMILES for bis(dichloroosmium);bis(1-methyl-4-propan-2-ylbenzene) is Cc1ccc(C(C)C)cc1.Cc1ccc(C(C)C)cc1.Cl[Os]Cl.Cl[Os]Cl.
What is the InChIKey of bis(dichloroosmium);bis(1-methyl-4-propan-2-ylbenzene)?
The InChIKey is XIHSXOFUHOTKGH-UHFFFAOYSA-J. The full InChI is InChI=1S/2C10H14.4ClH.2Os/c2*1-8(2)10-6-4-9(3)5-7-10;;;;;;/h2*4-8H,1-3H3;4*1H;;/q;;;;;;2*+2/p-4.
What are the key properties of bis(dichloroosmium);bis(1-methyl-4-propan-2-ylbenzene)?
bis(dichloroosmium);bis(1-methyl-4-propan-2-ylbenzene) has a molecular weight of 790.72 g/mol, XLogP of 8.99, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(dichloroosmium);bis(1-methyl-4-propan-2-ylbenzene) is sourced from PubChem (CID 10952856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).