2-[4-(1-ethylideneinden-2-yl)cyclopenta-1,4-dien-1-yl]oxyethanol

C18H18O2 — CID 87993799

IUPAC2-[4-(1-ethylideneinden-2-yl)cyclopenta-1,4-dien-1-yl]oxyethanol
SMILESCC=C1C(C2=CC(OCCO)=CC2)=Cc2ccccc21
InChIInChI=1S/C18H18O2/c1-2-16-17-6-4-3-5-13(17)12-18(16)14-7-8-15(11-14)20-10-9-19/h2-6,8,11-12,19H,7,9-10H2,1H3
InChIKeyORANFORDQYFXJF-UHFFFAOYSA-N
MW266.34 g/mol
LogP3.71
Rot. Bonds4

About 2-[4-(1-ethylideneinden-2-yl)cyclopenta-1,4-dien-1-yl]oxyethanol

2-[4-(1-ethylideneinden-2-yl)cyclopenta-1,4-dien-1-yl]oxyethanol (PubChem CID 87993799) has the molecular formula C18H18O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is 2-[4-(1-ethylideneinden-2-yl)cyclopenta-1,4-dien-1-yl]oxyethanol.

Molecular Properties

Compound Name2-[4-(1-ethylideneinden-2-yl)cyclopenta-1,4-dien-1-yl]oxyethanol
PubChem CID87993799
Molecular FormulaC18H18O2
Molecular Weight266.34 g/mol
Exact Mass266.13
IUPAC Name2-[4-(1-ethylideneinden-2-yl)cyclopenta-1,4-dien-1-yl]oxyethanol
SMILESCC=C1C(C2=CC(OCCO)=CC2)=Cc2ccccc21
InChIInChI=1S/C18H18O2/c1-2-16-17-6-4-3-5-13(17)12-18(16)14-7-8-15(11-14)20-10-9-19/h2-6,8,11-12,19H,7,9-10H2,1H3
InChIKeyORANFORDQYFXJF-UHFFFAOYSA-N
XLogP3.71
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[4-(1,1-dimethyl-6H-indeno[1,2-b]siliren-2-yl)cyclopenta-1,4-dien-1-yl]oxyethanol
CID 87993708
biphenylene;2-methoxyethanol
CID 69005385
2-[4-(9-ethyl-9H-fluoren-1-yl)phenoxy]ethanol
CID 118321734
ethyl (E)-6-[3-(2-hydroxyethoxy)cyclopenta-1,3-dien-1-yl]hex-2-enoate
CID 101176263
2-hydroxyethyl 4-(2-phenylphenyl)benzoate
CID 139650323
(1S)-1-[2-(2-hydroxyethoxy)phenyl]ethanol
CID 78931625
4-(2-ethoxyphenyl)phenol
CID 83129672
formic acid;2-phenoxyethanol
CID 71438669
2-(2-hydroxyethoxy)ethanol;toluene
CID 157148794
trimethyl-[2-[4-(2-propan-2-ylidene-9H-fluoren-9-id-1-yl)cyclopenta-1,4-dien-1-yl]oxyethoxy]silane;zirconium(3+);dichloride
CID 87936351
2-[2-(9H-fluoren-4-yl)-6-propan-2-ylphenoxy]ethanol
CID 172739883
2-[4-(9H-fluoren-1-yl)-2-methylphenoxy]ethanol
CID 66730243

Frequently Asked Questions

What is the IUPAC name of 2-[4-(1-ethylideneinden-2-yl)cyclopenta-1,4-dien-1-yl]oxyethanol?
The IUPAC name of 2-[4-(1-ethylideneinden-2-yl)cyclopenta-1,4-dien-1-yl]oxyethanol (CID 87993799) is 2-[4-(1-ethylideneinden-2-yl)cyclopenta-1,4-dien-1-yl]oxyethanol.
What is the SMILES notation for 2-[4-(1-ethylideneinden-2-yl)cyclopenta-1,4-dien-1-yl]oxyethanol?
The canonical SMILES for 2-[4-(1-ethylideneinden-2-yl)cyclopenta-1,4-dien-1-yl]oxyethanol is CC=C1C(C2=CC(OCCO)=CC2)=Cc2ccccc21.
What is the InChIKey of 2-[4-(1-ethylideneinden-2-yl)cyclopenta-1,4-dien-1-yl]oxyethanol?
The InChIKey is ORANFORDQYFXJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18O2/c1-2-16-17-6-4-3-5-13(17)12-18(16)14-7-8-15(11-14)20-10-9-19/h2-6,8,11-12,19H,7,9-10H2,1H3.
What are the key properties of 2-[4-(1-ethylideneinden-2-yl)cyclopenta-1,4-dien-1-yl]oxyethanol?
2-[4-(1-ethylideneinden-2-yl)cyclopenta-1,4-dien-1-yl]oxyethanol has a molecular weight of 266.34 g/mol, XLogP of 3.71, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1-ethylideneinden-2-yl)cyclopenta-1,4-dien-1-yl]oxyethanol is sourced from PubChem (CID 87993799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).