ethane;methane;1-methoxyethylidenetungsten;2-methylpropane;bis(propan-2-ylidenetungsten)

C16H38OW3 — CID 161251466

IUPACethane;methane;1-methoxyethylidenetungsten;2-methylpropane;bis(propan-2-ylidenetungsten)
SMILESC.CC.CC(C)=[W].CC(C)=[W].CC(C)C.COC(C)=[W]
InChIInChI=1S/C4H10.C3H6O.2C3H6.C2H6.CH4.3W/c1-4(2)3;1-3-4-2;2*1-3-2;1-2;;;;/h4H,1-3H3;1-2H3;2*1-2H3;1-2H3;1H4;;;
InChIKeyCDZDJIKAIUQVKT-UHFFFAOYSA-N
MW798.00 g/mol
LogP5.14
Rot. Bonds1

About ethane;methane;1-methoxyethylidenetungsten;2-methylpropane;bis(propan-2-ylidenetungsten)

ethane;methane;1-methoxyethylidenetungsten;2-methylpropane;bis(propan-2-ylidenetungsten) (PubChem CID 161251466) has the molecular formula C16H38OW3 and a molecular weight of 798.00 g/mol. Its IUPAC name is ethane;methane;1-methoxyethylidenetungsten;2-methylpropane;bis(propan-2-ylidenetungsten).

Molecular Properties

Compound Nameethane;methane;1-methoxyethylidenetungsten;2-methylpropane;bis(propan-2-ylidenetungsten)
PubChem CID161251466
Molecular FormulaC16H38OW3
Molecular Weight798.00 g/mol
Exact Mass798.15
IUPAC Nameethane;methane;1-methoxyethylidenetungsten;2-methylpropane;bis(propan-2-ylidenetungsten)
SMILESC.CC.CC(C)=[W].CC(C)=[W].CC(C)C.COC(C)=[W]
InChIInChI=1S/C4H10.C3H6O.2C3H6.C2H6.CH4.3W/c1-4(2)3;1-3-4-2;2*1-3-2;1-2;;;;/h4H,1-3H3;1-2H3;2*1-2H3;1-2H3;1H4;;;
InChIKeyCDZDJIKAIUQVKT-UHFFFAOYSA-N
XLogP5.14
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500798.00
LogP ≤ 55.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

ethane;methane;bis(2-methylpropane)
CID 142279596
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carbanide;ethane;propan-2-ylidenetungsten;yttrium
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ethane;tetrakis(2-methylpropane)
CID 160890290
carbon monoxide;(1-methoxy-2-methylpropylidene)tungsten
CID 135075924
CID 164988510
CID 164988510
2-chloropropane;methyl acetate
CID 157293612
acetic acid;1-methoxy-N-(1-methoxyethyl)ethanamine
CID 173051578
ethane;methane;methanol;methoxymethane
CID 159632193
methane;methyl acetate
CID 162094565
dimethyl carbonate;ethane
CID 160632176

Frequently Asked Questions

What is the IUPAC name of ethane;methane;1-methoxyethylidenetungsten;2-methylpropane;bis(propan-2-ylidenetungsten)?
The IUPAC name of ethane;methane;1-methoxyethylidenetungsten;2-methylpropane;bis(propan-2-ylidenetungsten) (CID 161251466) is ethane;methane;1-methoxyethylidenetungsten;2-methylpropane;bis(propan-2-ylidenetungsten).
What is the SMILES notation for ethane;methane;1-methoxyethylidenetungsten;2-methylpropane;bis(propan-2-ylidenetungsten)?
The canonical SMILES for ethane;methane;1-methoxyethylidenetungsten;2-methylpropane;bis(propan-2-ylidenetungsten) is C.CC.CC(C)=[W].CC(C)=[W].CC(C)C.COC(C)=[W].
What is the InChIKey of ethane;methane;1-methoxyethylidenetungsten;2-methylpropane;bis(propan-2-ylidenetungsten)?
The InChIKey is CDZDJIKAIUQVKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10.C3H6O.2C3H6.C2H6.CH4.3W/c1-4(2)3;1-3-4-2;2*1-3-2;1-2;;;;/h4H,1-3H3;1-2H3;2*1-2H3;1-2H3;1H4;;;.
What are the key properties of ethane;methane;1-methoxyethylidenetungsten;2-methylpropane;bis(propan-2-ylidenetungsten)?
ethane;methane;1-methoxyethylidenetungsten;2-methylpropane;bis(propan-2-ylidenetungsten) has a molecular weight of 798.00 g/mol, XLogP of 5.14, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;methane;1-methoxyethylidenetungsten;2-methylpropane;bis(propan-2-ylidenetungsten) is sourced from PubChem (CID 161251466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).