1,5,5,6-tetramethylcyclohexane-1,2-diol

C10H20O2 — CID 130145073

IUPAC1,5,5,6-tetramethylcyclohexane-1,2-diol
SMILESCC1C(C)(C)CCC(O)C1(C)O
InChIInChI=1S/C10H20O2/c1-7-9(2,3)6-5-8(11)10(7,4)12/h7-8,11-12H,5-6H2,1-4H3
InChIKeyDOZHLIUYDMEPST-UHFFFAOYSA-N
MW172.27 g/mol
LogP1.55
Rot. Bonds

About 1,5,5,6-tetramethylcyclohexane-1,2-diol

1,5,5,6-tetramethylcyclohexane-1,2-diol (PubChem CID 130145073) has the molecular formula C10H20O2 and a molecular weight of 172.27 g/mol. Its IUPAC name is 1,5,5,6-tetramethylcyclohexane-1,2-diol.

Molecular Properties

Compound Name1,5,5,6-tetramethylcyclohexane-1,2-diol
PubChem CID130145073
Molecular FormulaC10H20O2
Molecular Weight172.27 g/mol
Exact Mass172.15
IUPAC Name1,5,5,6-tetramethylcyclohexane-1,2-diol
SMILESCC1C(C)(C)CCC(O)C1(C)O
InChIInChI=1S/C10H20O2/c1-7-9(2,3)6-5-8(11)10(7,4)12/h7-8,11-12H,5-6H2,1-4H3
InChIKeyDOZHLIUYDMEPST-UHFFFAOYSA-N
XLogP1.55
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-1-methylcyclobutane-1,2-diol
CID 130694777
cis-(1S,5R)-2,2,5-trimethylcyclopentan-1-ol
CID 101036298
(2S)-1,1,2-trimethylcyclobutane
CID 59954523
trans-(1S,2R)-1-(dimethylamino)cyclobutane-1,2-diol
CID 151135809
(1S,8R,8aS)-4,4,8,8a-tetramethyl-2,3,4a,5,6,7-hexahydro-1H-naphthalene-1,8-diol
CID 101051820
8,8,9-trimethylspiro[3.5]nonan-7-ol
CID 123702304
3-ethyl-2,2,4,4-tetramethylcyclohexan-1-ol
CID 142000591
trans-(1R,4S)-2,2,4-trimethyl-4-(methylamino)cyclohexan-1-ol
CID 167021569
2,2,3,3-tetramethylcyclopentan-1-ol
CID 20584587
3,3-dimethylcyclopentane-1,2-diol
CID 22245615
4-ethyl-2,2,3,4-tetramethylcyclohexan-1-ol
CID 123306354
5,6-dimethyloxane-2,5-diol
CID 20542587

Frequently Asked Questions

What is the IUPAC name of 1,5,5,6-tetramethylcyclohexane-1,2-diol?
The IUPAC name of 1,5,5,6-tetramethylcyclohexane-1,2-diol (CID 130145073) is 1,5,5,6-tetramethylcyclohexane-1,2-diol.
What is the SMILES notation for 1,5,5,6-tetramethylcyclohexane-1,2-diol?
The canonical SMILES for 1,5,5,6-tetramethylcyclohexane-1,2-diol is CC1C(C)(C)CCC(O)C1(C)O.
What is the InChIKey of 1,5,5,6-tetramethylcyclohexane-1,2-diol?
The InChIKey is DOZHLIUYDMEPST-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O2/c1-7-9(2,3)6-5-8(11)10(7,4)12/h7-8,11-12H,5-6H2,1-4H3.
What are the key properties of 1,5,5,6-tetramethylcyclohexane-1,2-diol?
1,5,5,6-tetramethylcyclohexane-1,2-diol has a molecular weight of 172.27 g/mol, XLogP of 1.55, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5,5,6-tetramethylcyclohexane-1,2-diol is sourced from PubChem (CID 130145073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).