(6E,10Z)-hexadeca-1,6,10-triene

C16H28 — CID 5365621

IUPAC(6E,10Z)-hexadeca-1,6,10-triene
SMILESC=CCCC/C=C/CC/C=C\CCCCC
InChIInChI=1S/C16H28/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2/h3,11-14H,1,4-10,15-16H2,2H3/b13-11+,14-12-
InChIKeyMHYTXHWEEGYUHP-KPGXXQICSA-N
MW220.40 g/mol
LogP5.82
Rot. Bonds11

About (6E,10Z)-hexadeca-1,6,10-triene

(6E,10Z)-hexadeca-1,6,10-triene (PubChem CID 5365621) has the molecular formula C16H28 and a molecular weight of 220.40 g/mol. Its IUPAC name is (6E,10Z)-hexadeca-1,6,10-triene.

Molecular Properties

Compound Name(6E,10Z)-hexadeca-1,6,10-triene
PubChem CID5365621
Molecular FormulaC16H28
Molecular Weight220.40 g/mol
Exact Mass220.22
IUPAC Name(6E,10Z)-hexadeca-1,6,10-triene
SMILESC=CCCC/C=C/CC/C=C\CCCCC
InChIInChI=1S/C16H28/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2/h3,11-14H,1,4-10,15-16H2,2H3/b13-11+,14-12-
InChIKeyMHYTXHWEEGYUHP-KPGXXQICSA-N
XLogP5.82
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500220.40
LogP ≤ 55.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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

tricosa-1,6-diene
CID 175196703
triaconta-1,19-diene
CID 54007897
pentacosa-1,9,15-triene
CID 90876289
tetradeca-1,8-diene
CID 90913546
pentacosa-1,16-diene
CID 57082437
pentaconta-1,25-diene
CID 90941740
pentadeca-1,5,9-triene
CID 174048710
hexadeca-1,10-diene
CID 56606054
(10E)-hexadeca-1,10-diene
CID 156743041
hexadeca-1,7,11-triene
CID 174048514
heptadeca-1,7-diene
CID 57204265
(7E)-heptadeca-1,7-diene
CID 19050683

Frequently Asked Questions

What is the IUPAC name of (6E,10Z)-hexadeca-1,6,10-triene?
The IUPAC name of (6E,10Z)-hexadeca-1,6,10-triene (CID 5365621) is (6E,10Z)-hexadeca-1,6,10-triene.
What is the SMILES notation for (6E,10Z)-hexadeca-1,6,10-triene?
The canonical SMILES for (6E,10Z)-hexadeca-1,6,10-triene is C=CCCC/C=C/CC/C=C\CCCCC.
What is the InChIKey of (6E,10Z)-hexadeca-1,6,10-triene?
The InChIKey is MHYTXHWEEGYUHP-KPGXXQICSA-N. The full InChI is InChI=1S/C16H28/c1-3-5-7-9-11-13-15-16-14-12-10-8-6-4-2/h3,11-14H,1,4-10,15-16H2,2H3/b13-11+,14-12-.
What are the key properties of (6E,10Z)-hexadeca-1,6,10-triene?
(6E,10Z)-hexadeca-1,6,10-triene has a molecular weight of 220.40 g/mol, XLogP of 5.82, 11 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (6E,10Z)-hexadeca-1,6,10-triene is sourced from PubChem (CID 5365621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).