4-hepta-1,6-dien-4-yloxyhepta-1,6-diene

C14H22O — CID 23055063

IUPAC4-hepta-1,6-dien-4-yloxyhepta-1,6-diene
SMILESC=CCC(CC=C)OC(CC=C)CC=C
InChIInChI=1S/C14H22O/c1-5-9-13(10-6-2)15-14(11-7-3)12-8-4/h5-8,13-14H,1-4,9-12H2
InChIKeyFAODMNPVKISEPL-UHFFFAOYSA-N
MW206.33 g/mol
LogP4.04
Rot. Bonds10

About 4-hepta-1,6-dien-4-yloxyhepta-1,6-diene

4-hepta-1,6-dien-4-yloxyhepta-1,6-diene (PubChem CID 23055063) has the molecular formula C14H22O and a molecular weight of 206.33 g/mol. Its IUPAC name is 4-hepta-1,6-dien-4-yloxyhepta-1,6-diene.

Molecular Properties

Compound Name4-hepta-1,6-dien-4-yloxyhepta-1,6-diene
PubChem CID23055063
Molecular FormulaC14H22O
Molecular Weight206.33 g/mol
Exact Mass206.17
IUPAC Name4-hepta-1,6-dien-4-yloxyhepta-1,6-diene
SMILESC=CCC(CC=C)OC(CC=C)CC=C
InChIInChI=1S/C14H22O/c1-5-9-13(10-6-2)15-14(11-7-3)12-8-4/h5-8,13-14H,1-4,9-12H2
InChIKeyFAODMNPVKISEPL-UHFFFAOYSA-N
XLogP4.04
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.33
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

3-(1-hydroxyhex-5-en-3-yloxy)hex-5-en-1-ol
CID 139513174
7-chloro-4-(7-chlorohept-1-en-4-yloxy)hept-1-ene
CID 87687085
4-dodeca-1,11-dien-4-yloxydodeca-1,11-diene
CID 88718946
4,5-dimethoxypent-1-ene
CID 73040162
2-methoxypent-4-en-1-ol
CID 90985403
[(2S)-1-hydroxypent-4-en-2-yl] carbamate
CID 175099114
3-hexa-1,5-dien-3-yloxyhexa-1,5-diene;hydrochloride
CID 174646215
CID 22214462
CID 22214462
4-oct-1-en-4-ylperoxyoct-1-ene
CID 87401104
hepta-1,6-dien-4-yl methyl sulfate
CID 141147379
7-hydroxyhept-1-en-4-yl carbamate
CID 175099859
trimethyl(octa-1,7-dien-4-yloxy)silane
CID 18541557

Frequently Asked Questions

What is the IUPAC name of 4-hepta-1,6-dien-4-yloxyhepta-1,6-diene?
The IUPAC name of 4-hepta-1,6-dien-4-yloxyhepta-1,6-diene (CID 23055063) is 4-hepta-1,6-dien-4-yloxyhepta-1,6-diene.
What is the SMILES notation for 4-hepta-1,6-dien-4-yloxyhepta-1,6-diene?
The canonical SMILES for 4-hepta-1,6-dien-4-yloxyhepta-1,6-diene is C=CCC(CC=C)OC(CC=C)CC=C.
What is the InChIKey of 4-hepta-1,6-dien-4-yloxyhepta-1,6-diene?
The InChIKey is FAODMNPVKISEPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O/c1-5-9-13(10-6-2)15-14(11-7-3)12-8-4/h5-8,13-14H,1-4,9-12H2.
What are the key properties of 4-hepta-1,6-dien-4-yloxyhepta-1,6-diene?
4-hepta-1,6-dien-4-yloxyhepta-1,6-diene has a molecular weight of 206.33 g/mol, XLogP of 4.04, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hepta-1,6-dien-4-yloxyhepta-1,6-diene is sourced from PubChem (CID 23055063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).