7-(7-hydroxyhept-1-enoxy)hept-6-en-1-ol

C14H26O3 — CID 57238469

IUPAC7-(7-hydroxyhept-1-enoxy)hept-6-en-1-ol
SMILESOCCCCCC=COC=CCCCCCO
InChIInChI=1S/C14H26O3/c15-11-7-3-1-5-9-13-17-14-10-6-2-4-8-12-16/h9-10,13-16H,1-8,11-12H2
InChIKeyMUKFPGWYYLUHJY-UHFFFAOYSA-N
MW242.36 g/mol
LogP3.14
Rot. Bonds12

About 7-(7-hydroxyhept-1-enoxy)hept-6-en-1-ol

7-(7-hydroxyhept-1-enoxy)hept-6-en-1-ol (PubChem CID 57238469) has the molecular formula C14H26O3 and a molecular weight of 242.36 g/mol. Its IUPAC name is 7-(7-hydroxyhept-1-enoxy)hept-6-en-1-ol.

Molecular Properties

Compound Name7-(7-hydroxyhept-1-enoxy)hept-6-en-1-ol
PubChem CID57238469
Molecular FormulaC14H26O3
Molecular Weight242.36 g/mol
Exact Mass242.19
IUPAC Name7-(7-hydroxyhept-1-enoxy)hept-6-en-1-ol
SMILESOCCCCCC=COC=CCCCCCO
InChIInChI=1S/C14H26O3/c15-11-7-3-1-5-9-13-17-14-10-6-2-4-8-12-16/h9-10,13-16H,1-8,11-12H2
InChIKeyMUKFPGWYYLUHJY-UHFFFAOYSA-N
XLogP3.14
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

12-(12-hydroxydodec-1-enoxy)dodec-11-en-1-ol
CID 173344652
7-methoxyhept-6-en-1-ol
CID 85279707
hexadec-8-ene-1,16-diol
CID 54395986
(7Z,11Z)-octadeca-7,11-diene-1,18-diol
CID 171904791
(E)-hexadec-1-ene-1,16-diol
CID 57427575
heptadec-1-ene-1,17-diol
CID 142730253
1-triacont-1-enoxytriacont-1-ene
CID 173373575
1-hexadec-1-enoxyhexadec-1-ene
CID 57140599
CID 19982704
CID 19982704
sodium;(E)-hept-1-ene-1,7-diol;hydride
CID 174548415
6-fluoro-1-(6-fluorohex-1-enoxy)hex-1-ene
CID 91221242
(Z)-10-aminodec-5-en-1-ol
CID 10910016

Frequently Asked Questions

What is the IUPAC name of 7-(7-hydroxyhept-1-enoxy)hept-6-en-1-ol?
The IUPAC name of 7-(7-hydroxyhept-1-enoxy)hept-6-en-1-ol (CID 57238469) is 7-(7-hydroxyhept-1-enoxy)hept-6-en-1-ol.
What is the SMILES notation for 7-(7-hydroxyhept-1-enoxy)hept-6-en-1-ol?
The canonical SMILES for 7-(7-hydroxyhept-1-enoxy)hept-6-en-1-ol is OCCCCCC=COC=CCCCCCO.
What is the InChIKey of 7-(7-hydroxyhept-1-enoxy)hept-6-en-1-ol?
The InChIKey is MUKFPGWYYLUHJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O3/c15-11-7-3-1-5-9-13-17-14-10-6-2-4-8-12-16/h9-10,13-16H,1-8,11-12H2.
What are the key properties of 7-(7-hydroxyhept-1-enoxy)hept-6-en-1-ol?
7-(7-hydroxyhept-1-enoxy)hept-6-en-1-ol has a molecular weight of 242.36 g/mol, XLogP of 3.14, 12 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(7-hydroxyhept-1-enoxy)hept-6-en-1-ol is sourced from PubChem (CID 57238469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).