acetic acid;(Z)-tetradec-8-en-1-ol

C16H32O3 — CID 175504388

IUPACacetic acid;(Z)-tetradec-8-en-1-ol
SMILESCC(=O)O.CCCCC/C=C\CCCCCCCO
InChIInChI=1S/C14H28O.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15;1-2(3)4/h6-7,15H,2-5,8-14H2,1H3;1H3,(H,3,4)/b7-6-;
InChIKeyFKLOJMCZYAUMLY-NAFXZHHSSA-N
MW272.43 g/mol
LogP4.55
Rot. Bonds11

About acetic acid;(Z)-tetradec-8-en-1-ol

acetic acid;(Z)-tetradec-8-en-1-ol (PubChem CID 175504388) has the molecular formula C16H32O3 and a molecular weight of 272.43 g/mol. Its IUPAC name is acetic acid;(Z)-tetradec-8-en-1-ol.

Molecular Properties

Compound Nameacetic acid;(Z)-tetradec-8-en-1-ol
PubChem CID175504388
Molecular FormulaC16H32O3
Molecular Weight272.43 g/mol
Exact Mass272.24
IUPAC Nameacetic acid;(Z)-tetradec-8-en-1-ol
SMILESCC(=O)O.CCCCC/C=C\CCCCCCCO
InChIInChI=1S/C14H28O.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15;1-2(3)4/h6-7,15H,2-5,8-14H2,1H3;1H3,(H,3,4)/b7-6-;
InChIKeyFKLOJMCZYAUMLY-NAFXZHHSSA-N
XLogP4.55
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.43
LogP ≤ 54.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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

acetic acid;hexadec-10-en-1-ol
CID 71444791
acetic acid;(Z)-tridec-3-en-1-ol
CID 175355445
acetic acid;(E)-tetradec-7-ene
CID 174697247
(E)-heptadec-5-en-1-ol
CID 170849266
(E)-heptadec-7-en-1-ol
CID 19790013
(5Z,11Z)-icosa-5,11-dien-1-ol
CID 51353972
henicos-10-en-1-ol
CID 86069169
(Z)-octadec-7-en-1-ol
CID 13338918
(E)-henicos-12-en-1-ol
CID 19702453
hexacos-17-en-1-ol
CID 139697197
octadec-9-en-1-ol
CID 8927
(E)-docos-9-en-1-ol
CID 23502502

Frequently Asked Questions

What is the IUPAC name of acetic acid;(Z)-tetradec-8-en-1-ol?
The IUPAC name of acetic acid;(Z)-tetradec-8-en-1-ol (CID 175504388) is acetic acid;(Z)-tetradec-8-en-1-ol.
What is the SMILES notation for acetic acid;(Z)-tetradec-8-en-1-ol?
The canonical SMILES for acetic acid;(Z)-tetradec-8-en-1-ol is CC(=O)O.CCCCC/C=C\CCCCCCCO.
What is the InChIKey of acetic acid;(Z)-tetradec-8-en-1-ol?
The InChIKey is FKLOJMCZYAUMLY-NAFXZHHSSA-N. The full InChI is InChI=1S/C14H28O.C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15;1-2(3)4/h6-7,15H,2-5,8-14H2,1H3;1H3,(H,3,4)/b7-6-;.
What are the key properties of acetic acid;(Z)-tetradec-8-en-1-ol?
acetic acid;(Z)-tetradec-8-en-1-ol has a molecular weight of 272.43 g/mol, XLogP of 4.55, 11 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for acetic acid;(Z)-tetradec-8-en-1-ol is sourced from PubChem (CID 175504388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).