(4R,6R)-2,8-dimethylnona-1,8-diene-4,6-diol

C11H20O2 — CID 134964814

IUPAC(4R,6R)-2,8-dimethylnona-1,8-diene-4,6-diol
SMILESC=C(C)C[C@@H](O)C[C@H](O)CC(=C)C
InChIInChI=1S/C11H20O2/c1-8(2)5-10(12)7-11(13)6-9(3)4/h10-13H,1,3,5-7H2,2,4H3/t10-,11-/m1/s1
InChIKeyRTJUTUUXAQHNFY-GHMZBOCLSA-N
MW184.28 g/mol
LogP2.03
Rot. Bonds6

About (4R,6R)-2,8-dimethylnona-1,8-diene-4,6-diol

(4R,6R)-2,8-dimethylnona-1,8-diene-4,6-diol (PubChem CID 134964814) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is (4R,6R)-2,8-dimethylnona-1,8-diene-4,6-diol.

Molecular Properties

Compound Name(4R,6R)-2,8-dimethylnona-1,8-diene-4,6-diol
PubChem CID134964814
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name(4R,6R)-2,8-dimethylnona-1,8-diene-4,6-diol
SMILESC=C(C)C[C@@H](O)C[C@H](O)CC(=C)C
InChIInChI=1S/C11H20O2/c1-8(2)5-10(12)7-11(13)6-9(3)4/h10-13H,1,3,5-7H2,2,4H3/t10-,11-/m1/s1
InChIKeyRTJUTUUXAQHNFY-GHMZBOCLSA-N
XLogP2.03
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

6-methylhept-6-ene-2,4-diol
CID 57030596
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CID 141111870
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CID 115816985
1-ethoxy-4-methylpent-4-en-2-ol
CID 79178687
(4R)-2-methylnon-1-en-6-yn-4-ol
CID 157249533
1-cyclohexyl-4-methylpent-4-en-2-ol
CID 115816975
2,4-dimethylpent-1-ene;ethane
CID 143336990
1,1,1-trifluoro-4-methylpent-4-en-2-ol
CID 79177366
2-methyloct-1-ene-4,5-diol
CID 103454915
(4R,6R)-4,6-dihydroxyoctan-2-one
CID 58846635
2-chloro-2,5-dimethylhex-5-en-3-ol
CID 18920966
1-cyclopropyl-3-methylbut-3-en-1-ol
CID 79179792

Frequently Asked Questions

What is the IUPAC name of (4R,6R)-2,8-dimethylnona-1,8-diene-4,6-diol?
The IUPAC name of (4R,6R)-2,8-dimethylnona-1,8-diene-4,6-diol (CID 134964814) is (4R,6R)-2,8-dimethylnona-1,8-diene-4,6-diol.
What is the SMILES notation for (4R,6R)-2,8-dimethylnona-1,8-diene-4,6-diol?
The canonical SMILES for (4R,6R)-2,8-dimethylnona-1,8-diene-4,6-diol is C=C(C)C[C@@H](O)C[C@H](O)CC(=C)C.
What is the InChIKey of (4R,6R)-2,8-dimethylnona-1,8-diene-4,6-diol?
The InChIKey is RTJUTUUXAQHNFY-GHMZBOCLSA-N. The full InChI is InChI=1S/C11H20O2/c1-8(2)5-10(12)7-11(13)6-9(3)4/h10-13H,1,3,5-7H2,2,4H3/t10-,11-/m1/s1.
What are the key properties of (4R,6R)-2,8-dimethylnona-1,8-diene-4,6-diol?
(4R,6R)-2,8-dimethylnona-1,8-diene-4,6-diol has a molecular weight of 184.28 g/mol, XLogP of 2.03, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,6R)-2,8-dimethylnona-1,8-diene-4,6-diol is sourced from PubChem (CID 134964814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).