(7Z)-hexadeca-7,11-dien-5-ol

C16H30O — CID 87164825

IUPAC(7Z)-hexadeca-7,11-dien-5-ol
SMILESCCCCC=CCC/C=C\CC(O)CCCC
InChIInChI=1S/C16H30O/c1-3-5-7-8-9-10-11-12-13-15-16(17)14-6-4-2/h8-9,12-13,16-17H,3-7,10-11,14-15H2,1-2H3/b9-8?,13-12-
InChIKeyRDPCJBXDDMDCCQ-RIWRDTRSSA-N
MW238.41 g/mol
LogP5.01
Rot. Bonds11

About (7Z)-hexadeca-7,11-dien-5-ol

(7Z)-hexadeca-7,11-dien-5-ol (PubChem CID 87164825) has the molecular formula C16H30O and a molecular weight of 238.41 g/mol. Its IUPAC name is (7Z)-hexadeca-7,11-dien-5-ol.

Molecular Properties

Compound Name(7Z)-hexadeca-7,11-dien-5-ol
PubChem CID87164825
Molecular FormulaC16H30O
Molecular Weight238.41 g/mol
Exact Mass238.23
IUPAC Name(7Z)-hexadeca-7,11-dien-5-ol
SMILESCCCCC=CCC/C=C\CC(O)CCCC
InChIInChI=1S/C16H30O/c1-3-5-7-8-9-10-11-12-13-15-16(17)14-6-4-2/h8-9,12-13,16-17H,3-7,10-11,14-15H2,1-2H3/b9-8?,13-12-
InChIKeyRDPCJBXDDMDCCQ-RIWRDTRSSA-N
XLogP5.01
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms17
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500238.41
LogP ≤ 55.01
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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Frequently Asked Questions

What is the IUPAC name of (7Z)-hexadeca-7,11-dien-5-ol?
The IUPAC name of (7Z)-hexadeca-7,11-dien-5-ol (CID 87164825) is (7Z)-hexadeca-7,11-dien-5-ol.
What is the SMILES notation for (7Z)-hexadeca-7,11-dien-5-ol?
The canonical SMILES for (7Z)-hexadeca-7,11-dien-5-ol is CCCCC=CCC/C=C\CC(O)CCCC.
What is the InChIKey of (7Z)-hexadeca-7,11-dien-5-ol?
The InChIKey is RDPCJBXDDMDCCQ-RIWRDTRSSA-N. The full InChI is InChI=1S/C16H30O/c1-3-5-7-8-9-10-11-12-13-15-16(17)14-6-4-2/h8-9,12-13,16-17H,3-7,10-11,14-15H2,1-2H3/b9-8?,13-12-.
What are the key properties of (7Z)-hexadeca-7,11-dien-5-ol?
(7Z)-hexadeca-7,11-dien-5-ol has a molecular weight of 238.41 g/mol, XLogP of 5.01, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (7Z)-hexadeca-7,11-dien-5-ol is sourced from PubChem (CID 87164825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).