carbanide;bis(cyclopentane);2-cyclopentylethyl-dihydroxy-methylsilane;dichloro-(2-cyclopentylethyl)-methylsilane;bis(iron(2+))

C30H66Cl2Fe2O2Si2 — CID 162297223

IUPACcarbanide;bis(cyclopentane);2-cyclopentylethyl-dihydroxy-methylsilane;dichloro-(2-cyclopentylethyl)-methylsilane;bis(iron(2+))
SMILESC1CCCC1.C1CCCC1.C[Si](Cl)(Cl)CCC1CCCC1.C[Si](O)(O)CCC1CCCC1.[CH3-].[CH3-].[CH3-].[CH3-].[Fe+2].[Fe+2]
InChIInChI=1S/C8H16Cl2Si.C8H18O2Si.2C5H10.4CH3.2Fe/c2*1-11(9,10)7-6-8-4-2-3-5-8;2*1-2-4-5-3-1;;;;;;/h8H,2-7H2,1H3;8-10H,2-7H2,1H3;2*1-5H2;4*1H3;;/q;;;;4*-1;2*+2
InChIKeyASNODCQXKNUSRG-UHFFFAOYSA-N
MW697.62 g/mol
LogP11.44
Rot. Bonds6

About carbanide;bis(cyclopentane);2-cyclopentylethyl-dihydroxy-methylsilane;dichloro-(2-cyclopentylethyl)-methylsilane;bis(iron(2+))

carbanide;bis(cyclopentane);2-cyclopentylethyl-dihydroxy-methylsilane;dichloro-(2-cyclopentylethyl)-methylsilane;bis(iron(2+)) (PubChem CID 162297223) has the molecular formula C30H66Cl2Fe2O2Si2 and a molecular weight of 697.62 g/mol. Its IUPAC name is carbanide;bis(cyclopentane);2-cyclopentylethyl-dihydroxy-methylsilane;dichloro-(2-cyclopentylethyl)-methylsilane;bis(iron(2+)).

Molecular Properties

Compound Namecarbanide;bis(cyclopentane);2-cyclopentylethyl-dihydroxy-methylsilane;dichloro-(2-cyclopentylethyl)-methylsilane;bis(iron(2+))
PubChem CID162297223
Molecular FormulaC30H66Cl2Fe2O2Si2
Molecular Weight697.62 g/mol
Exact Mass696.27
IUPAC Namecarbanide;bis(cyclopentane);2-cyclopentylethyl-dihydroxy-methylsilane;dichloro-(2-cyclopentylethyl)-methylsilane;bis(iron(2+))
SMILESC1CCCC1.C1CCCC1.C[Si](Cl)(Cl)CCC1CCCC1.C[Si](O)(O)CCC1CCCC1.[CH3-].[CH3-].[CH3-].[CH3-].[Fe+2].[Fe+2]
InChIInChI=1S/C8H16Cl2Si.C8H18O2Si.2C5H10.4CH3.2Fe/c2*1-11(9,10)7-6-8-4-2-3-5-8;2*1-2-4-5-3-1;;;;;;/h8H,2-7H2,1H3;8-10H,2-7H2,1H3;2*1-5H2;4*1H3;;/q;;;;4*-1;2*+2
InChIKeyASNODCQXKNUSRG-UHFFFAOYSA-N
XLogP11.44
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500697.62
LogP ≤ 511.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of carbanide;bis(cyclopentane);2-cyclopentylethyl-dihydroxy-methylsilane;dichloro-(2-cyclopentylethyl)-methylsilane;bis(iron(2+))?
The IUPAC name of carbanide;bis(cyclopentane);2-cyclopentylethyl-dihydroxy-methylsilane;dichloro-(2-cyclopentylethyl)-methylsilane;bis(iron(2+)) (CID 162297223) is carbanide;bis(cyclopentane);2-cyclopentylethyl-dihydroxy-methylsilane;dichloro-(2-cyclopentylethyl)-methylsilane;bis(iron(2+)).
What is the SMILES notation for carbanide;bis(cyclopentane);2-cyclopentylethyl-dihydroxy-methylsilane;dichloro-(2-cyclopentylethyl)-methylsilane;bis(iron(2+))?
The canonical SMILES for carbanide;bis(cyclopentane);2-cyclopentylethyl-dihydroxy-methylsilane;dichloro-(2-cyclopentylethyl)-methylsilane;bis(iron(2+)) is C1CCCC1.C1CCCC1.C[Si](Cl)(Cl)CCC1CCCC1.C[Si](O)(O)CCC1CCCC1.[CH3-].[CH3-].[CH3-].[CH3-].[Fe+2].[Fe+2].
What is the InChIKey of carbanide;bis(cyclopentane);2-cyclopentylethyl-dihydroxy-methylsilane;dichloro-(2-cyclopentylethyl)-methylsilane;bis(iron(2+))?
The InChIKey is ASNODCQXKNUSRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16Cl2Si.C8H18O2Si.2C5H10.4CH3.2Fe/c2*1-11(9,10)7-6-8-4-2-3-5-8;2*1-2-4-5-3-1;;;;;;/h8H,2-7H2,1H3;8-10H,2-7H2,1H3;2*1-5H2;4*1H3;;/q;;;;4*-1;2*+2.
What are the key properties of carbanide;bis(cyclopentane);2-cyclopentylethyl-dihydroxy-methylsilane;dichloro-(2-cyclopentylethyl)-methylsilane;bis(iron(2+))?
carbanide;bis(cyclopentane);2-cyclopentylethyl-dihydroxy-methylsilane;dichloro-(2-cyclopentylethyl)-methylsilane;bis(iron(2+)) has a molecular weight of 697.62 g/mol, XLogP of 11.44, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;bis(cyclopentane);2-cyclopentylethyl-dihydroxy-methylsilane;dichloro-(2-cyclopentylethyl)-methylsilane;bis(iron(2+)) is sourced from PubChem (CID 162297223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).