zinc;1,2-dimethoxyethane;iodomethane

C6H14I2O2Zn — CID 11144627

IUPACzinc;1,2-dimethoxyethane;iodomethane
SMILESCOCCOC.[CH2-]I.[CH2-]I.[Zn+2]
InChIInChI=1S/C4H10O2.2CH2I.Zn/c1-5-3-4-6-2;2*1-2;/h3-4H2,1-2H3;2*1H2;/q;2*-1;+2
InChIKeyYWLBHJMTZHTZBG-UHFFFAOYSA-N
MW437.37 g/mol
LogP2.70
Rot. Bonds3

About zinc;1,2-dimethoxyethane;iodomethane

zinc;1,2-dimethoxyethane;iodomethane (PubChem CID 11144627) has the molecular formula C6H14I2O2Zn and a molecular weight of 437.37 g/mol. Its IUPAC name is zinc;1,2-dimethoxyethane;iodomethane.

Molecular Properties

Compound Namezinc;1,2-dimethoxyethane;iodomethane
PubChem CID11144627
Molecular FormulaC6H14I2O2Zn
Molecular Weight437.37 g/mol
Exact Mass435.84
IUPAC Namezinc;1,2-dimethoxyethane;iodomethane
SMILESCOCCOC.[CH2-]I.[CH2-]I.[Zn+2]
InChIInChI=1S/C4H10O2.2CH2I.Zn/c1-5-3-4-6-2;2*1-2;/h3-4H2,1-2H3;2*1H2;/q;2*-1;+2
InChIKeyYWLBHJMTZHTZBG-UHFFFAOYSA-N
XLogP2.70
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.37
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,2-dimethoxyethane;ethane
CID 91349162
1,2-dimethoxyethane;samarium
CID 174304250
CID 172826348
CID 172826348
magnesium;1,2-dimethoxyethane;dichloride
CID 174702876
1,2-dimethoxyethane;niobium;hydrochloride
CID 88933065
azane;1,2-dimethoxyethane;hydrochloride
CID 175079035
1,2-dimethoxyethane;nickel(2+);dichloride
CID 22904217
barium(2+);1,2-dimethoxyethane;dibromide
CID 173394585
zinc;carbanide;1-methoxy-2-(2-methoxyethoxy)ethane
CID 161464033
1,2-dimethoxyethane;methoxyethane;yttrium
CID 161194141
1,2-dimethoxyethane;N-methylmethanamine
CID 175177446
1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane
CID 8189

Frequently Asked Questions

What is the IUPAC name of zinc;1,2-dimethoxyethane;iodomethane?
The IUPAC name of zinc;1,2-dimethoxyethane;iodomethane (CID 11144627) is zinc;1,2-dimethoxyethane;iodomethane.
What is the SMILES notation for zinc;1,2-dimethoxyethane;iodomethane?
The canonical SMILES for zinc;1,2-dimethoxyethane;iodomethane is COCCOC.[CH2-]I.[CH2-]I.[Zn+2].
What is the InChIKey of zinc;1,2-dimethoxyethane;iodomethane?
The InChIKey is YWLBHJMTZHTZBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O2.2CH2I.Zn/c1-5-3-4-6-2;2*1-2;/h3-4H2,1-2H3;2*1H2;/q;2*-1;+2.
What are the key properties of zinc;1,2-dimethoxyethane;iodomethane?
zinc;1,2-dimethoxyethane;iodomethane has a molecular weight of 437.37 g/mol, XLogP of 2.70, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for zinc;1,2-dimethoxyethane;iodomethane is sourced from PubChem (CID 11144627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).