3,7-dihydro-2H-cyclopenta[b][1,4]dioxine;ethane

C9H14O2 — CID 145272383

IUPAC3,7-dihydro-2H-cyclopenta[b][1,4]dioxine;ethane
SMILESC1=CC2=C(C1)OCCO2.CC
InChIInChI=1S/C7H8O2.C2H6/c1-2-6-7(3-1)9-5-4-8-6;1-2/h1-2H,3-5H2;1-2H3
InChIKeyYJTXVYIDROGXAZ-UHFFFAOYSA-N
MW154.21 g/mol
LogP2.23
Rot. Bonds

About 3,7-dihydro-2H-cyclopenta[b][1,4]dioxine;ethane

3,7-dihydro-2H-cyclopenta[b][1,4]dioxine;ethane (PubChem CID 145272383) has the molecular formula C9H14O2 and a molecular weight of 154.21 g/mol. Its IUPAC name is 3,7-dihydro-2H-cyclopenta[b][1,4]dioxine;ethane.

Molecular Properties

Compound Name3,7-dihydro-2H-cyclopenta[b][1,4]dioxine;ethane
PubChem CID145272383
Molecular FormulaC9H14O2
Molecular Weight154.21 g/mol
Exact Mass154.10
IUPAC Name3,7-dihydro-2H-cyclopenta[b][1,4]dioxine;ethane
SMILESC1=CC2=C(C1)OCCO2.CC
InChIInChI=1S/C7H8O2.C2H6/c1-2-6-7(3-1)9-5-4-8-6;1-2/h1-2H,3-5H2;1-2H3
InChIKeyYJTXVYIDROGXAZ-UHFFFAOYSA-N
XLogP2.23
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,7-dihydro-2H-cyclohepta[b][1,4]dioxin-6-yloxymethyl)acetamide
CID 129295926
4-methyl-2,3,4,5-tetrahydro-1-benzofuran
CID 142210898
N-methyl-2,3,7,8-tetrahydro-1,4-benzodioxin-6-amine
CID 142987823
5-tert-butyl-5-(2,3,7,8-tetrahydro-1,4-benzodioxin-7-yl)imidazolidine-2,4-dione
CID 140546531
2,3,5,6-tetrahydro-1,4-benzodioxine-5-carboxylic acid
CID 140523622
4,8-dimethyl-1,7-dihydrocyclohepta[c]furan-3-one
CID 143996276
7,7-dimethyl-3,4-dihydro-2H-cyclohepta[b]pyran;ethane
CID 143072426
12,12-dimethyl-11-oxa-7,8-diazatricyclo[6.4.0.02,6]dodeca-1,3,6-triene;ethane
CID 162283830
trimethyl-(7-trimethylsilyl-1H-inden-4-yl)silane
CID 87995564
2-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)propan-1-ol
CID 105424219
1-ethyl-2-methylcyclopenta-1,3-diene
CID 18355720
2,2-dimethyl-6H-cyclohepta[d][1,3]dioxole
CID 142414090

Frequently Asked Questions

What is the IUPAC name of 3,7-dihydro-2H-cyclopenta[b][1,4]dioxine;ethane?
The IUPAC name of 3,7-dihydro-2H-cyclopenta[b][1,4]dioxine;ethane (CID 145272383) is 3,7-dihydro-2H-cyclopenta[b][1,4]dioxine;ethane.
What is the SMILES notation for 3,7-dihydro-2H-cyclopenta[b][1,4]dioxine;ethane?
The canonical SMILES for 3,7-dihydro-2H-cyclopenta[b][1,4]dioxine;ethane is C1=CC2=C(C1)OCCO2.CC.
What is the InChIKey of 3,7-dihydro-2H-cyclopenta[b][1,4]dioxine;ethane?
The InChIKey is YJTXVYIDROGXAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8O2.C2H6/c1-2-6-7(3-1)9-5-4-8-6;1-2/h1-2H,3-5H2;1-2H3.
What are the key properties of 3,7-dihydro-2H-cyclopenta[b][1,4]dioxine;ethane?
3,7-dihydro-2H-cyclopenta[b][1,4]dioxine;ethane has a molecular weight of 154.21 g/mol, XLogP of 2.23, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,7-dihydro-2H-cyclopenta[b][1,4]dioxine;ethane is sourced from PubChem (CID 145272383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).