methanol;1,1,2-trimethylcyclohexane

C10H22O — CID 70292509

IUPACmethanol;1,1,2-trimethylcyclohexane
SMILESCC1CCCCC1(C)C.CO
InChIInChI=1S/C9H18.CH4O/c1-8-6-4-5-7-9(8,2)3;1-2/h8H,4-7H2,1-3H3;2H,1H3
InChIKeyMIVLEVQQOVJMAL-UHFFFAOYSA-N
MW158.28 g/mol
LogP2.83
Rot. Bonds

About methanol;1,1,2-trimethylcyclohexane

methanol;1,1,2-trimethylcyclohexane (PubChem CID 70292509) has the molecular formula C10H22O and a molecular weight of 158.28 g/mol. Its IUPAC name is methanol;1,1,2-trimethylcyclohexane.

Molecular Properties

Compound Namemethanol;1,1,2-trimethylcyclohexane
PubChem CID70292509
Molecular FormulaC10H22O
Molecular Weight158.28 g/mol
Exact Mass158.17
IUPAC Namemethanol;1,1,2-trimethylcyclohexane
SMILESCC1CCCCC1(C)C.CO
InChIInChI=1S/C9H18.CH4O/c1-8-6-4-5-7-9(8,2)3;1-2/h8H,4-7H2,1-3H3;2H,1H3
InChIKeyMIVLEVQQOVJMAL-UHFFFAOYSA-N
XLogP2.83
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.28
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1,1,2-trimethylcycloundecane
CID 544748
2-methyloxirane;1,1,2-trimethylcyclohexane
CID 20977929
isothiocyanic acid;1,1,2-trimethylcyclohexane
CID 174786251
2,2-dimethylcyclohexan-1-ol
CID 557637
trichloro-(1,2-dimethylcyclohexyl)silane
CID 18798602
(2S)-1,1,2-trimethylcyclobutane
CID 59954523
5-hydroxy-2-methylidenepent-4-enoic acid;1,1,2-trimethylcyclohexane
CID 174668266
1,1,2,7-tetramethylcyclooctane
CID 141451493
CID 173459900
CID 173459900
2-methyl-1-(1-methylcyclononyl)cyclotetradecan-1-ol
CID 130369263
(9R)-9-methylspiro[3.5]nonane
CID 140885739
1,1,2,8-tetramethylcyclononane
CID 123968014

Frequently Asked Questions

What is the IUPAC name of methanol;1,1,2-trimethylcyclohexane?
The IUPAC name of methanol;1,1,2-trimethylcyclohexane (CID 70292509) is methanol;1,1,2-trimethylcyclohexane.
What is the SMILES notation for methanol;1,1,2-trimethylcyclohexane?
The canonical SMILES for methanol;1,1,2-trimethylcyclohexane is CC1CCCCC1(C)C.CO.
What is the InChIKey of methanol;1,1,2-trimethylcyclohexane?
The InChIKey is MIVLEVQQOVJMAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18.CH4O/c1-8-6-4-5-7-9(8,2)3;1-2/h8H,4-7H2,1-3H3;2H,1H3.
What are the key properties of methanol;1,1,2-trimethylcyclohexane?
methanol;1,1,2-trimethylcyclohexane has a molecular weight of 158.28 g/mol, XLogP of 2.83, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methanol;1,1,2-trimethylcyclohexane is sourced from PubChem (CID 70292509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).