dicyclopropylmethanolate;diethylalumanylium

C11H21AlO — CID 87070822

IUPACdicyclopropylmethanolate;diethylalumanylium
SMILESCC[Al+]CC.[O-]C(C1CC1)C1CC1
InChIInChI=1S/C7H11O.2C2H5.Al/c8-7(5-1-2-5)6-3-4-6;2*1-2;/h5-7H,1-4H2;2*1H2,2H3;/q-1;;;+1
InChIKeyJVMDMZCZKZAAMY-UHFFFAOYSA-N
MW196.27 g/mol
LogP2.10
Rot. Bonds4

About dicyclopropylmethanolate;diethylalumanylium

dicyclopropylmethanolate;diethylalumanylium (PubChem CID 87070822) has the molecular formula C11H21AlO and a molecular weight of 196.27 g/mol. Its IUPAC name is dicyclopropylmethanolate;diethylalumanylium.

Molecular Properties

Compound Namedicyclopropylmethanolate;diethylalumanylium
PubChem CID87070822
Molecular FormulaC11H21AlO
Molecular Weight196.27 g/mol
Exact Mass196.14
IUPAC Namedicyclopropylmethanolate;diethylalumanylium
SMILESCC[Al+]CC.[O-]C(C1CC1)C1CC1
InChIInChI=1S/C7H11O.2C2H5.Al/c8-7(5-1-2-5)6-3-4-6;2*1-2;/h5-7H,1-4H2;2*1H2,2H3;/q-1;;;+1
InChIKeyJVMDMZCZKZAAMY-UHFFFAOYSA-N
XLogP2.10
TPSA23.06 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.27
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

diethylalumanylium;titanium(4+);tetrachloride;fluoride
CID 159607865
pentan-3-ylcyclopropane
CID 19042038
[(1S)-1-fluoropropyl]cyclopropane
CID 158184537
1-chloropropylcyclopropane;methane
CID 174336736
heptane;1-methyl-4-propan-2-ylcyclohexane
CID 145172646
1-cyclopropyloctylcyclopropane
CID 141276542
octan-2-ylcyclopropane
CID 18968125
2-cyclopropylhexadecanoic acid
CID 67041212
2-cyclopropylnonanoic acid
CID 139682006
1-butan-2-yl-4-propan-2-yloxycyclohexane
CID 23528463
1-bromotetradecylcyclopropane
CID 55193412
4-(1-chloropropyl)-1,2-dimethylcyclohexane
CID 79307796

Frequently Asked Questions

What is the IUPAC name of dicyclopropylmethanolate;diethylalumanylium?
The IUPAC name of dicyclopropylmethanolate;diethylalumanylium (CID 87070822) is dicyclopropylmethanolate;diethylalumanylium.
What is the SMILES notation for dicyclopropylmethanolate;diethylalumanylium?
The canonical SMILES for dicyclopropylmethanolate;diethylalumanylium is CC[Al+]CC.[O-]C(C1CC1)C1CC1.
What is the InChIKey of dicyclopropylmethanolate;diethylalumanylium?
The InChIKey is JVMDMZCZKZAAMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11O.2C2H5.Al/c8-7(5-1-2-5)6-3-4-6;2*1-2;/h5-7H,1-4H2;2*1H2,2H3;/q-1;;;+1.
What are the key properties of dicyclopropylmethanolate;diethylalumanylium?
dicyclopropylmethanolate;diethylalumanylium has a molecular weight of 196.27 g/mol, XLogP of 2.10, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dicyclopropylmethanolate;diethylalumanylium is sourced from PubChem (CID 87070822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).