4-dodeca-1,11-dien-4-yloxydodeca-1,11-diene

C24H42O — CID 88718946

IUPAC4-dodeca-1,11-dien-4-yloxydodeca-1,11-diene
SMILESC=CCCCCCCC(CC=C)OC(CC=C)CCCCCCC=C
InChIInChI=1S/C24H42O/c1-5-9-11-13-15-17-21-23(19-7-3)25-24(20-8-4)22-18-16-14-12-10-6-2/h5-8,23-24H,1-4,9-22H2
InChIKeyYYUOLLOUKATVCJ-UHFFFAOYSA-N
MW346.60 g/mol
LogP7.95
Rot. Bonds20

About 4-dodeca-1,11-dien-4-yloxydodeca-1,11-diene

4-dodeca-1,11-dien-4-yloxydodeca-1,11-diene (PubChem CID 88718946) has the molecular formula C24H42O and a molecular weight of 346.60 g/mol. Its IUPAC name is 4-dodeca-1,11-dien-4-yloxydodeca-1,11-diene.

Molecular Properties

Compound Name4-dodeca-1,11-dien-4-yloxydodeca-1,11-diene
PubChem CID88718946
Molecular FormulaC24H42O
Molecular Weight346.60 g/mol
Exact Mass346.32
IUPAC Name4-dodeca-1,11-dien-4-yloxydodeca-1,11-diene
SMILESC=CCCCCCCC(CC=C)OC(CC=C)CCCCCCC=C
InChIInChI=1S/C24H42O/c1-5-9-11-13-15-17-21-23(19-7-3)25-24(20-8-4)22-18-16-14-12-10-6-2/h5-8,23-24H,1-4,9-22H2
InChIKeyYYUOLLOUKATVCJ-UHFFFAOYSA-N
XLogP7.95
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds20
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500346.60
LogP ≤ 57.95
H-Bond Donors ≤ 50
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

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CID 87687085
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CID 23055063
octadec-17-ene-1,1-diamine
CID 87111501
3-tetradeca-1,13-dien-3-yloxytetradeca-1,13-diene
CID 57120298
3-(1-hydroxyhex-5-en-3-yloxy)hex-5-en-1-ol
CID 139513174
heptadeca-1,16-diene
CID 6429392
heptacosa-1,26-diene
CID 58905535
13-pent-4-enylheptacosa-1,26-diene
CID 91232021
nonacosa-1,28-dien-15-yl acetate
CID 101064980
7-methoxynon-1-ene
CID 91435315
10-(4-bromobutoxy)nonadeca-1,18-diene
CID 146462897
[(4S)-nona-1,8-dien-4-yl] methanesulfonate
CID 52952537

Frequently Asked Questions

What is the IUPAC name of 4-dodeca-1,11-dien-4-yloxydodeca-1,11-diene?
The IUPAC name of 4-dodeca-1,11-dien-4-yloxydodeca-1,11-diene (CID 88718946) is 4-dodeca-1,11-dien-4-yloxydodeca-1,11-diene.
What is the SMILES notation for 4-dodeca-1,11-dien-4-yloxydodeca-1,11-diene?
The canonical SMILES for 4-dodeca-1,11-dien-4-yloxydodeca-1,11-diene is C=CCCCCCCC(CC=C)OC(CC=C)CCCCCCC=C.
What is the InChIKey of 4-dodeca-1,11-dien-4-yloxydodeca-1,11-diene?
The InChIKey is YYUOLLOUKATVCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H42O/c1-5-9-11-13-15-17-21-23(19-7-3)25-24(20-8-4)22-18-16-14-12-10-6-2/h5-8,23-24H,1-4,9-22H2.
What are the key properties of 4-dodeca-1,11-dien-4-yloxydodeca-1,11-diene?
4-dodeca-1,11-dien-4-yloxydodeca-1,11-diene has a molecular weight of 346.60 g/mol, XLogP of 7.95, 20 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-dodeca-1,11-dien-4-yloxydodeca-1,11-diene is sourced from PubChem (CID 88718946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).