2-ethylhexan-1-olate;rubidium(1+)

C8H17ORb — CID 87215334

IUPAC2-ethylhexan-1-olate;rubidium(1+)
SMILESCCCCC(CC)C[O-].[Rb+]
InChIInChI=1S/C8H17O.Rb/c1-3-5-6-8(4-2)7-9;/h8H,3-7H2,1-2H3;/q-1;+1
InChIKeyKEXGWMPUGCWLCP-UHFFFAOYSA-N
MW214.69 g/mol
LogP-1.43
Rot. Bonds5

About 2-ethylhexan-1-olate;rubidium(1+)

2-ethylhexan-1-olate;rubidium(1+) (PubChem CID 87215334) has the molecular formula C8H17ORb and a molecular weight of 214.69 g/mol. Its IUPAC name is 2-ethylhexan-1-olate;rubidium(1+).

Molecular Properties

Compound Name2-ethylhexan-1-olate;rubidium(1+)
PubChem CID87215334
Molecular FormulaC8H17ORb
Molecular Weight214.69 g/mol
Exact Mass214.04
IUPAC Name2-ethylhexan-1-olate;rubidium(1+)
SMILESCCCCC(CC)C[O-].[Rb+]
InChIInChI=1S/C8H17O.Rb/c1-3-5-6-8(4-2)7-9;/h8H,3-7H2,1-2H3;/q-1;+1
InChIKeyKEXGWMPUGCWLCP-UHFFFAOYSA-N
XLogP-1.43
TPSA23.06 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.69
LogP ≤ 5-1.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-(Butoxymethyl)heptane
CID 522064
Hexane, 1-(hexyloxy)-3-methyl-
CID 537316
Hexane, 1-(hexyloxy)-4-methyl-
CID 545916
Sodium 2-ethylhexanolate
CID 23669613
Sulfurous acid, 2-ethylhexyl isohexyl ester
CID 6420722
2-Ethyl-1-hexanol, methyl ether
CID 14795002
1-Isobutoxy-2-ethylhexane
CID 545495
1-Methoxy-2-methylhexane
CID 14868104
(2-Ethyl-hexoxy)silane
CID 22186351
Methyl 2-propylhexyl ether
CID 59274500
3,5-Dimethylhexyl methyl ether
CID 87509083
3-(Ethoxymethyl)heptane
CID 21252455

Frequently Asked Questions

What is the IUPAC name of 2-ethylhexan-1-olate;rubidium(1+)?
The IUPAC name of 2-ethylhexan-1-olate;rubidium(1+) (CID 87215334) is 2-ethylhexan-1-olate;rubidium(1+).
What is the SMILES notation for 2-ethylhexan-1-olate;rubidium(1+)?
The canonical SMILES for 2-ethylhexan-1-olate;rubidium(1+) is CCCCC(CC)C[O-].[Rb+].
What is the InChIKey of 2-ethylhexan-1-olate;rubidium(1+)?
The InChIKey is KEXGWMPUGCWLCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17O.Rb/c1-3-5-6-8(4-2)7-9;/h8H,3-7H2,1-2H3;/q-1;+1.
What are the key properties of 2-ethylhexan-1-olate;rubidium(1+)?
2-ethylhexan-1-olate;rubidium(1+) has a molecular weight of 214.69 g/mol, XLogP of -1.43, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethylhexan-1-olate;rubidium(1+) is sourced from PubChem (CID 87215334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).