ethane;1-ethoxy-2,2-bis(methoxymethyl)butane;vanadium

C12H28O3V — CID 144965251

IUPACethane;1-ethoxy-2,2-bis(methoxymethyl)butane;vanadium
SMILESCC.CCOCC(CC)(COC)COC.[V]
InChIInChI=1S/C10H22O3.C2H6.V/c1-5-10(7-11-3,8-12-4)9-13-6-2;1-2;/h5-9H2,1-4H3;1-2H3;
InChIKeyPBCYLLBDGJZUEA-UHFFFAOYSA-N
MW271.30 g/mol
LogP2.74
Rot. Bonds8

About ethane;1-ethoxy-2,2-bis(methoxymethyl)butane;vanadium

ethane;1-ethoxy-2,2-bis(methoxymethyl)butane;vanadium (PubChem CID 144965251) has the molecular formula C12H28O3V and a molecular weight of 271.30 g/mol. Its IUPAC name is ethane;1-ethoxy-2,2-bis(methoxymethyl)butane;vanadium.

Molecular Properties

Compound Nameethane;1-ethoxy-2,2-bis(methoxymethyl)butane;vanadium
PubChem CID144965251
Molecular FormulaC12H28O3V
Molecular Weight271.30 g/mol
Exact Mass271.15
IUPAC Nameethane;1-ethoxy-2,2-bis(methoxymethyl)butane;vanadium
SMILESCC.CCOCC(CC)(COC)COC.[V]
InChIInChI=1S/C10H22O3.C2H6.V/c1-5-10(7-11-3,8-12-4)9-13-6-2;1-2;/h5-9H2,1-4H3;1-2H3;
InChIKeyPBCYLLBDGJZUEA-UHFFFAOYSA-N
XLogP2.74
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.30
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-bromo-2-(bromomethyl)-2-(ethoxymethyl)butane
CID 103985337
1-methoxy-2,2-bis[(2-methylpropan-2-yl)oxymethyl]butane
CID 171725386
1-methoxy-2-(methoxymethyl)-2-[(2-methylpropan-2-yl)oxymethyl]butane
CID 86682667
1-ethoxy-3-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-2,2-bis[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxymethyl]propane
CID 123158943
4,4-bis(ethoxymethyl)-2-methylhexane
CID 89107052
3-[[2-[[2-(2,2-diethylbutoxymethyl)-2-ethylbutoxy]methyl]-2-ethylbutoxy]methyl]-3-ethylpentane
CID 129159634
2,2-bis(hydroxymethoxymethyl)butoxymethanol
CID 126644173
CID 58841248
CID 58841248
1,3-diethoxy-2,2-bis(ethoxymethyl)propane;tetrakis(N,N-dimethylmethanamine);tetrahydroiodide
CID 173321778
8-(ethoxymethyl)-8-ethyl-3,3-difluoro-2,2-dimethyldecane
CID 118527073
[2-(methoxymethyl)-2-(prop-2-enoyloxymethoxymethyl)butoxy]methyl prop-2-enoate
CID 129178860
ethane;1-ethoxy-2,2-dimethylpropane
CID 155734553

Frequently Asked Questions

What is the IUPAC name of ethane;1-ethoxy-2,2-bis(methoxymethyl)butane;vanadium?
The IUPAC name of ethane;1-ethoxy-2,2-bis(methoxymethyl)butane;vanadium (CID 144965251) is ethane;1-ethoxy-2,2-bis(methoxymethyl)butane;vanadium.
What is the SMILES notation for ethane;1-ethoxy-2,2-bis(methoxymethyl)butane;vanadium?
The canonical SMILES for ethane;1-ethoxy-2,2-bis(methoxymethyl)butane;vanadium is CC.CCOCC(CC)(COC)COC.[V].
What is the InChIKey of ethane;1-ethoxy-2,2-bis(methoxymethyl)butane;vanadium?
The InChIKey is PBCYLLBDGJZUEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O3.C2H6.V/c1-5-10(7-11-3,8-12-4)9-13-6-2;1-2;/h5-9H2,1-4H3;1-2H3;.
What are the key properties of ethane;1-ethoxy-2,2-bis(methoxymethyl)butane;vanadium?
ethane;1-ethoxy-2,2-bis(methoxymethyl)butane;vanadium has a molecular weight of 271.30 g/mol, XLogP of 2.74, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-ethoxy-2,2-bis(methoxymethyl)butane;vanadium is sourced from PubChem (CID 144965251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).