lithium (5R)-5-methylcyclohexen-1-olate

C7H11LiO — CID 134975809

IUPAClithium (5R)-5-methylcyclohexen-1-olate
SMILESC[C@@H]1CCC=C([O-])C1.[Li+]
InChIInChI=1S/C7H12O.Li/c1-6-3-2-4-7(8)5-6;/h4,6,8H,2-3,5H2,1H3;/q;+1/p-1/t6-;/m1./s1
InChIKeyUDRGTKOUZLNDFR-FYZOBXCZSA-M
MW118.10 g/mol
LogP-1.95
Rot. Bonds

About lithium (5R)-5-methylcyclohexen-1-olate

lithium (5R)-5-methylcyclohexen-1-olate (PubChem CID 134975809) has the molecular formula C7H11LiO and a molecular weight of 118.10 g/mol. Its IUPAC name is lithium (5R)-5-methylcyclohexen-1-olate.

Molecular Properties

Compound Namelithium (5R)-5-methylcyclohexen-1-olate
PubChem CID134975809
Molecular FormulaC7H11LiO
Molecular Weight118.10 g/mol
Exact Mass118.10
IUPAC Namelithium (5R)-5-methylcyclohexen-1-olate
SMILESC[C@@H]1CCC=C([O-])C1.[Li+]
InChIInChI=1S/C7H12O.Li/c1-6-3-2-4-7(8)5-6;/h4,6,8H,2-3,5H2,1H3;/q;+1/p-1/t6-;/m1./s1
InChIKeyUDRGTKOUZLNDFR-FYZOBXCZSA-M
XLogP-1.95
TPSA23.06 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.10
LogP ≤ 5-1.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-Methoxy-3-methylcyclohexene
CID 519381
3-Methylcyclohexanolen
CID 14489841
Lithium 6-methylcyclohexen-1-olate
CID 23682383
[(Z)-4-ethylhept-2-en-3-yl] hypofluorite
CID 168879608
lithium (3R,5S)-3,5-dimethylcyclohexen-1-olate
CID 23666726
Potassium 6-methylcyclohexen-1-olate
CID 23685818
lithium (4S)-4-tert-butylcyclohexen-1-olate
CID 23691561
Lithium 3-butylcyclohexen-1-olate
CID 23713748
Lithium 5-methylcyclopenten-1-olate
CID 23719264
4-Ethyl cyclohexenol
CID 86004407
Lithium 3-methylcyclohexen-1-olate
CID 100940055
lithium (4R)-4-tert-butylcyclohexen-1-olate
CID 102585708

Frequently Asked Questions

What is the IUPAC name of lithium (5R)-5-methylcyclohexen-1-olate?
The IUPAC name of lithium (5R)-5-methylcyclohexen-1-olate (CID 134975809) is lithium (5R)-5-methylcyclohexen-1-olate.
What is the SMILES notation for lithium (5R)-5-methylcyclohexen-1-olate?
The canonical SMILES for lithium (5R)-5-methylcyclohexen-1-olate is C[C@@H]1CCC=C([O-])C1.[Li+].
What is the InChIKey of lithium (5R)-5-methylcyclohexen-1-olate?
The InChIKey is UDRGTKOUZLNDFR-FYZOBXCZSA-M. The full InChI is InChI=1S/C7H12O.Li/c1-6-3-2-4-7(8)5-6;/h4,6,8H,2-3,5H2,1H3;/q;+1/p-1/t6-;/m1./s1.
What are the key properties of lithium (5R)-5-methylcyclohexen-1-olate?
lithium (5R)-5-methylcyclohexen-1-olate has a molecular weight of 118.10 g/mol, XLogP of -1.95, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium (5R)-5-methylcyclohexen-1-olate is sourced from PubChem (CID 134975809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).