(E)-nonadec-4-en-1-ol

C19H38O — CID 87881885

IUPAC(E)-nonadec-4-en-1-ol
SMILESCCCCCCCCCCCCCC/C=C/CCCO
InChIInChI=1S/C19H38O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20/h15-16,20H,2-14,17-19H2,1H3/b16-15+
InChIKeyPCNHXNUQUUFWJB-FOCLMDBBSA-N
MW282.51 g/mol
LogP6.41
Rot. Bonds16

About (E)-nonadec-4-en-1-ol

(E)-nonadec-4-en-1-ol (PubChem CID 87881885) has the molecular formula C19H38O and a molecular weight of 282.51 g/mol. Its IUPAC name is (E)-nonadec-4-en-1-ol.

Molecular Properties

Compound Name(E)-nonadec-4-en-1-ol
PubChem CID87881885
Molecular FormulaC19H38O
Molecular Weight282.51 g/mol
Exact Mass282.29
IUPAC Name(E)-nonadec-4-en-1-ol
SMILESCCCCCCCCCCCCCC/C=C/CCCO
InChIInChI=1S/C19H38O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20/h15-16,20H,2-14,17-19H2,1H3/b16-15+
InChIKeyPCNHXNUQUUFWJB-FOCLMDBBSA-N
XLogP6.41
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds16
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500282.51
LogP ≤ 56.41
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

(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
(Z)-triacont-9-en-1-ol
CID 170943144
octadec-9-en-1-ol
CID 8927
(E)-docos-9-en-1-ol
CID 23502502
(Z)-icos-9-en-1-ol;hydrate
CID 174442786
azane;(Z)-octadec-9-en-1-ol
CID 166664850

Frequently Asked Questions

What is the IUPAC name of (E)-nonadec-4-en-1-ol?
The IUPAC name of (E)-nonadec-4-en-1-ol (CID 87881885) is (E)-nonadec-4-en-1-ol.
What is the SMILES notation for (E)-nonadec-4-en-1-ol?
The canonical SMILES for (E)-nonadec-4-en-1-ol is CCCCCCCCCCCCCC/C=C/CCCO.
What is the InChIKey of (E)-nonadec-4-en-1-ol?
The InChIKey is PCNHXNUQUUFWJB-FOCLMDBBSA-N. The full InChI is InChI=1S/C19H38O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20/h15-16,20H,2-14,17-19H2,1H3/b16-15+.
What are the key properties of (E)-nonadec-4-en-1-ol?
(E)-nonadec-4-en-1-ol has a molecular weight of 282.51 g/mol, XLogP of 6.41, 16 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-nonadec-4-en-1-ol is sourced from PubChem (CID 87881885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).