(13Z)-1,4,7,10-tetraoxacyclotetradec-13-ene

C10H18O4 — CID 18730149

IUPAC(13Z)-1,4,7,10-tetraoxacyclotetradec-13-ene
SMILESC1=C\OCCOCCOCCOCC/1
InChIInChI=1S/C10H18O4/c1-2-4-12-6-8-14-10-9-13-7-5-11-3-1/h1,3H,2,4-10H2/b3-1-
InChIKeyKJJXWEPVESRSCZ-IWQZZHSRSA-N
MW202.25 g/mol
LogP0.97
Rot. Bonds

About (13Z)-1,4,7,10-tetraoxacyclotetradec-13-ene

(13Z)-1,4,7,10-tetraoxacyclotetradec-13-ene (PubChem CID 18730149) has the molecular formula C10H18O4 and a molecular weight of 202.25 g/mol. Its IUPAC name is (13Z)-1,4,7,10-tetraoxacyclotetradec-13-ene.

Molecular Properties

Compound Name(13Z)-1,4,7,10-tetraoxacyclotetradec-13-ene
PubChem CID18730149
Molecular FormulaC10H18O4
Molecular Weight202.25 g/mol
Exact Mass202.12
IUPAC Name(13Z)-1,4,7,10-tetraoxacyclotetradec-13-ene
SMILESC1=C\OCCOCCOCCOCC/1
InChIInChI=1S/C10H18O4/c1-2-4-12-6-8-14-10-9-13-7-5-11-3-1/h1,3H,2,4-10H2/b3-1-
InChIKeyKJJXWEPVESRSCZ-IWQZZHSRSA-N
XLogP0.97
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 50.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (13Z)-1,4,7,10-tetraoxacyclotetradec-13-ene?
The IUPAC name of (13Z)-1,4,7,10-tetraoxacyclotetradec-13-ene (CID 18730149) is (13Z)-1,4,7,10-tetraoxacyclotetradec-13-ene.
What is the SMILES notation for (13Z)-1,4,7,10-tetraoxacyclotetradec-13-ene?
The canonical SMILES for (13Z)-1,4,7,10-tetraoxacyclotetradec-13-ene is C1=C\OCCOCCOCCOCC/1.
What is the InChIKey of (13Z)-1,4,7,10-tetraoxacyclotetradec-13-ene?
The InChIKey is KJJXWEPVESRSCZ-IWQZZHSRSA-N. The full InChI is InChI=1S/C10H18O4/c1-2-4-12-6-8-14-10-9-13-7-5-11-3-1/h1,3H,2,4-10H2/b3-1-.
What are the key properties of (13Z)-1,4,7,10-tetraoxacyclotetradec-13-ene?
(13Z)-1,4,7,10-tetraoxacyclotetradec-13-ene has a molecular weight of 202.25 g/mol, XLogP of 0.97, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (13Z)-1,4,7,10-tetraoxacyclotetradec-13-ene is sourced from PubChem (CID 18730149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).