2,4,6,8-tetramethyldecane-1,8-diol

C14H30O2 — CID 87893087

IUPAC2,4,6,8-tetramethyldecane-1,8-diol
SMILESCCC(C)(O)CC(C)CC(C)CC(C)CO
InChIInChI=1S/C14H30O2/c1-6-14(5,16)9-12(3)7-11(2)8-13(4)10-15/h11-13,15-16H,6-10H2,1-5H3
InChIKeyLIYVWOSMXZLGMH-UHFFFAOYSA-N
MW230.39 g/mol
LogP3.22
Rot. Bonds8

About 2,4,6,8-tetramethyldecane-1,8-diol

2,4,6,8-tetramethyldecane-1,8-diol (PubChem CID 87893087) has the molecular formula C14H30O2 and a molecular weight of 230.39 g/mol. Its IUPAC name is 2,4,6,8-tetramethyldecane-1,8-diol.

Molecular Properties

Compound Name2,4,6,8-tetramethyldecane-1,8-diol
PubChem CID87893087
Molecular FormulaC14H30O2
Molecular Weight230.39 g/mol
Exact Mass230.22
IUPAC Name2,4,6,8-tetramethyldecane-1,8-diol
SMILESCCC(C)(O)CC(C)CC(C)CC(C)CO
InChIInChI=1S/C14H30O2/c1-6-14(5,16)9-12(3)7-11(2)8-13(4)10-15/h11-13,15-16H,6-10H2,1-5H3
InChIKeyLIYVWOSMXZLGMH-UHFFFAOYSA-N
XLogP3.22
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.39
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,4,6,8-tetramethyldecane-1,8-diol?
The IUPAC name of 2,4,6,8-tetramethyldecane-1,8-diol (CID 87893087) is 2,4,6,8-tetramethyldecane-1,8-diol.
What is the SMILES notation for 2,4,6,8-tetramethyldecane-1,8-diol?
The canonical SMILES for 2,4,6,8-tetramethyldecane-1,8-diol is CCC(C)(O)CC(C)CC(C)CC(C)CO.
What is the InChIKey of 2,4,6,8-tetramethyldecane-1,8-diol?
The InChIKey is LIYVWOSMXZLGMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30O2/c1-6-14(5,16)9-12(3)7-11(2)8-13(4)10-15/h11-13,15-16H,6-10H2,1-5H3.
What are the key properties of 2,4,6,8-tetramethyldecane-1,8-diol?
2,4,6,8-tetramethyldecane-1,8-diol has a molecular weight of 230.39 g/mol, XLogP of 3.22, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6,8-tetramethyldecane-1,8-diol is sourced from PubChem (CID 87893087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).