gold;2-methylhexan-2-ol

C7H16AuO — CID 18513333

IUPACgold;2-methylhexan-2-ol
SMILESCCCCC(C)(C)O.[Au]
InChIInChI=1S/C7H16O.Au/c1-4-5-6-7(2,3)8;/h8H,4-6H2,1-3H3;
InChIKeyCURJPQUXQQAVJN-UHFFFAOYSA-N
MW313.17 g/mol
LogP1.95
Rot. Bonds3

About gold;2-methylhexan-2-ol

gold;2-methylhexan-2-ol (PubChem CID 18513333) has the molecular formula C7H16AuO and a molecular weight of 313.17 g/mol. Its IUPAC name is gold;2-methylhexan-2-ol.

Molecular Properties

Compound Namegold;2-methylhexan-2-ol
PubChem CID18513333
Molecular FormulaC7H16AuO
Molecular Weight313.17 g/mol
Exact Mass313.09
IUPAC Namegold;2-methylhexan-2-ol
SMILESCCCCC(C)(C)O.[Au]
InChIInChI=1S/C7H16O.Au/c1-4-5-6-7(2,3)8;/h8H,4-6H2,1-3H3;
InChIKeyCURJPQUXQQAVJN-UHFFFAOYSA-N
XLogP1.95
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.17
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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(E)-5,8-dimethyldodec-6-ene-5,8-diol
CID 22223420
azane;2-methylheptan-2-ol;trifluoromethanesulfonic acid
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2-methylnonan-2-ol;2,2,2-trifluoroacetic acid
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2,2-dimethylhexane
CID 169424592

Frequently Asked Questions

What is the IUPAC name of gold;2-methylhexan-2-ol?
The IUPAC name of gold;2-methylhexan-2-ol (CID 18513333) is gold;2-methylhexan-2-ol.
What is the SMILES notation for gold;2-methylhexan-2-ol?
The canonical SMILES for gold;2-methylhexan-2-ol is CCCCC(C)(C)O.[Au].
What is the InChIKey of gold;2-methylhexan-2-ol?
The InChIKey is CURJPQUXQQAVJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16O.Au/c1-4-5-6-7(2,3)8;/h8H,4-6H2,1-3H3;.
What are the key properties of gold;2-methylhexan-2-ol?
gold;2-methylhexan-2-ol has a molecular weight of 313.17 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for gold;2-methylhexan-2-ol is sourced from PubChem (CID 18513333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).