(3R,5S)-3-methyldec-1-en-5-ol

C11H22O — CID 135060658

IUPAC(3R,5S)-3-methyldec-1-en-5-ol
SMILESC=C[C@H](C)C[C@@H](O)CCCCC
InChIInChI=1S/C11H22O/c1-4-6-7-8-11(12)9-10(3)5-2/h5,10-12H,2,4,6-9H2,1,3H3/t10-,11-/m0/s1
InChIKeyGWENZRATCWPTBM-QWRGUYRKSA-N
MW170.30 g/mol
LogP3.14
Rot. Bonds7

About (3R,5S)-3-methyldec-1-en-5-ol

(3R,5S)-3-methyldec-1-en-5-ol (PubChem CID 135060658) has the molecular formula C11H22O and a molecular weight of 170.30 g/mol. Its IUPAC name is (3R,5S)-3-methyldec-1-en-5-ol.

Molecular Properties

Compound Name(3R,5S)-3-methyldec-1-en-5-ol
PubChem CID135060658
Molecular FormulaC11H22O
Molecular Weight170.30 g/mol
Exact Mass170.17
IUPAC Name(3R,5S)-3-methyldec-1-en-5-ol
SMILESC=C[C@H](C)C[C@@H](O)CCCCC
InChIInChI=1S/C11H22O/c1-4-6-7-8-11(12)9-10(3)5-2/h5,10-12H,2,4,6-9H2,1,3H3/t10-,11-/m0/s1
InChIKeyGWENZRATCWPTBM-QWRGUYRKSA-N
XLogP3.14
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(4S)-2-methylnonan-4-ol
CID 86308805
(7S,9R)-tetratriacontane-7,9-diol
CID 165357894
(5S,7R)-dodecane-5,7-diol
CID 12060471
hentriacontane-14,16-diol
CID 87514654
triacontane-6,8-diol
CID 85096450
(6S,8S)-heptacosane-6,8-diol
CID 10693038
nonacos-1-ene-4,6,8,10,12,14,16,18,20,22,24-undecol
CID 121434328
(2R,4R)-decane-2,4-diol
CID 16752205
3-deuteriooct-1-en-3-ol
CID 91592547
(4R)-dodec-1-en-4-ol
CID 11074077
(3S,5S)-2-methylundecane-3,5-diol
CID 14784007
3-methyltridecan-5-ol
CID 13025106

Frequently Asked Questions

What is the IUPAC name of (3R,5S)-3-methyldec-1-en-5-ol?
The IUPAC name of (3R,5S)-3-methyldec-1-en-5-ol (CID 135060658) is (3R,5S)-3-methyldec-1-en-5-ol.
What is the SMILES notation for (3R,5S)-3-methyldec-1-en-5-ol?
The canonical SMILES for (3R,5S)-3-methyldec-1-en-5-ol is C=C[C@H](C)C[C@@H](O)CCCCC.
What is the InChIKey of (3R,5S)-3-methyldec-1-en-5-ol?
The InChIKey is GWENZRATCWPTBM-QWRGUYRKSA-N. The full InChI is InChI=1S/C11H22O/c1-4-6-7-8-11(12)9-10(3)5-2/h5,10-12H,2,4,6-9H2,1,3H3/t10-,11-/m0/s1.
What are the key properties of (3R,5S)-3-methyldec-1-en-5-ol?
(3R,5S)-3-methyldec-1-en-5-ol has a molecular weight of 170.30 g/mol, XLogP of 3.14, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,5S)-3-methyldec-1-en-5-ol is sourced from PubChem (CID 135060658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).