(3E)-3-ethylocta-3,7-dien-2-ol

C10H18O — CID 88713488

IUPAC(3E)-3-ethylocta-3,7-dien-2-ol
SMILESC=CCC/C=C(\CC)C(C)O
InChIInChI=1S/C10H18O/c1-4-6-7-8-10(5-2)9(3)11/h4,8-9,11H,1,5-7H2,2-3H3/b10-8+
InChIKeyUAELSERXYDUUIT-CSKARUKUSA-N
MW154.25 g/mol
LogP2.67
Rot. Bonds5

About (3E)-3-ethylocta-3,7-dien-2-ol

(3E)-3-ethylocta-3,7-dien-2-ol (PubChem CID 88713488) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is (3E)-3-ethylocta-3,7-dien-2-ol.

Molecular Properties

Compound Name(3E)-3-ethylocta-3,7-dien-2-ol
PubChem CID88713488
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name(3E)-3-ethylocta-3,7-dien-2-ol
SMILESC=CCC/C=C(\CC)C(C)O
InChIInChI=1S/C10H18O/c1-4-6-7-8-10(5-2)9(3)11/h4,8-9,11H,1,5-7H2,2-3H3/b10-8+
InChIKeyUAELSERXYDUUIT-CSKARUKUSA-N
XLogP2.67
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.67
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

(3E)-3-methylocta-3,7-dien-2-ol
CID 20501690
(3E)-3-hexylnona-3,8-dien-2-ol
CID 101365454
(3Z)-3-[(prop-2-enylideneamino)methylidene]pentan-2-ol
CID 163779494
6-ethyl-10-methylundeca-1,5-diene
CID 58970902
(4E)-4-methylnona-4,8-dien-3-one
CID 20501818
3-propyldodec-3-en-2-ol
CID 71375191
5-methyl-6,7-dimethylidenenon-1-ene
CID 142109737
(2R,3S)-hept-6-ene-2,3-diol
CID 102384670
2-prop-2-enylidenebutane-1,3-diol
CID 175263998
10-methylundeca-1,5,9-triene
CID 71330376
hexa-1,5-diene;propane-1,2,3-triol
CID 91872897
hexa-1,5-diene;propane;propan-1-ol
CID 145351847

Frequently Asked Questions

What is the IUPAC name of (3E)-3-ethylocta-3,7-dien-2-ol?
The IUPAC name of (3E)-3-ethylocta-3,7-dien-2-ol (CID 88713488) is (3E)-3-ethylocta-3,7-dien-2-ol.
What is the SMILES notation for (3E)-3-ethylocta-3,7-dien-2-ol?
The canonical SMILES for (3E)-3-ethylocta-3,7-dien-2-ol is C=CCC/C=C(\CC)C(C)O.
What is the InChIKey of (3E)-3-ethylocta-3,7-dien-2-ol?
The InChIKey is UAELSERXYDUUIT-CSKARUKUSA-N. The full InChI is InChI=1S/C10H18O/c1-4-6-7-8-10(5-2)9(3)11/h4,8-9,11H,1,5-7H2,2-3H3/b10-8+.
What are the key properties of (3E)-3-ethylocta-3,7-dien-2-ol?
(3E)-3-ethylocta-3,7-dien-2-ol has a molecular weight of 154.25 g/mol, XLogP of 2.67, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3E)-3-ethylocta-3,7-dien-2-ol is sourced from PubChem (CID 88713488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).