5-nonoxycyclopenta-1,3-diene

C14H24O — CID 172821169

IUPAC5-nonoxycyclopenta-1,3-diene
SMILESCCCCCCCCCOC1C=CC=C1
InChIInChI=1S/C14H24O/c1-2-3-4-5-6-7-10-13-15-14-11-8-9-12-14/h8-9,11-12,14H,2-7,10,13H2,1H3
InChIKeyUFZZTJWGUACFMI-UHFFFAOYSA-N
MW208.35 g/mol
LogP4.25
Rot. Bonds9

About 5-nonoxycyclopenta-1,3-diene

5-nonoxycyclopenta-1,3-diene (PubChem CID 172821169) has the molecular formula C14H24O and a molecular weight of 208.35 g/mol. Its IUPAC name is 5-nonoxycyclopenta-1,3-diene.

Molecular Properties

Compound Name5-nonoxycyclopenta-1,3-diene
PubChem CID172821169
Molecular FormulaC14H24O
Molecular Weight208.35 g/mol
Exact Mass208.18
IUPAC Name5-nonoxycyclopenta-1,3-diene
SMILESCCCCCCCCCOC1C=CC=C1
InChIInChI=1S/C14H24O/c1-2-3-4-5-6-7-10-13-15-14-11-8-9-12-14/h8-9,11-12,14H,2-7,10,13H2,1H3
InChIKeyUFZZTJWGUACFMI-UHFFFAOYSA-N
XLogP4.25
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.35
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

5-undecylcyclopenta-1,3-diene
CID 141280590
heptoxycyclopropane
CID 54099544
dodecylmercury;hydrate
CID 78070234
di(cyclopenta-2,4-dien-1-yl)-dihexoxysilane
CID 100958472
5-[2-(2-ethoxyethoxy)ethoxy]cyclopenta-1,3-diene
CID 154404410
magnesium;5-ethoxycyclopenta-1,3-diene;hydride
CID 174744942
3-heptoxy-N-methylcyclobutan-1-amine
CID 66356812
pentadecoxycyclopentane
CID 155570194
1-ethoxy-4-hexoxycyclohexane
CID 147022477
octoxycyclopentane
CID 14691467
(1S,3R,4S,5R)-4-heptoxy-5-[methyl(nonyl)amino]cyclopentane-1,3-diol
CID 70583774
decane;ruthenium
CID 160818595

Frequently Asked Questions

What is the IUPAC name of 5-nonoxycyclopenta-1,3-diene?
The IUPAC name of 5-nonoxycyclopenta-1,3-diene (CID 172821169) is 5-nonoxycyclopenta-1,3-diene.
What is the SMILES notation for 5-nonoxycyclopenta-1,3-diene?
The canonical SMILES for 5-nonoxycyclopenta-1,3-diene is CCCCCCCCCOC1C=CC=C1.
What is the InChIKey of 5-nonoxycyclopenta-1,3-diene?
The InChIKey is UFZZTJWGUACFMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O/c1-2-3-4-5-6-7-10-13-15-14-11-8-9-12-14/h8-9,11-12,14H,2-7,10,13H2,1H3.
What are the key properties of 5-nonoxycyclopenta-1,3-diene?
5-nonoxycyclopenta-1,3-diene has a molecular weight of 208.35 g/mol, XLogP of 4.25, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-nonoxycyclopenta-1,3-diene is sourced from PubChem (CID 172821169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).