ethane;4-propa-1,2-dienyloxane

C10H18O — CID 143862152

IUPACethane;4-propa-1,2-dienyloxane
SMILESC=C=CC1CCOCC1.CC
InChIInChI=1S/C8H12O.C2H6/c1-2-3-8-4-6-9-7-5-8;1-2/h3,8H,1,4-7H2;1-2H3
InChIKeyLQYTUTRHOWKEGS-UHFFFAOYSA-N
MW154.25 g/mol
LogP2.78
Rot. Bonds1

About ethane;4-propa-1,2-dienyloxane

ethane;4-propa-1,2-dienyloxane (PubChem CID 143862152) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is ethane;4-propa-1,2-dienyloxane.

Molecular Properties

Compound Nameethane;4-propa-1,2-dienyloxane
PubChem CID143862152
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Nameethane;4-propa-1,2-dienyloxane
SMILESC=C=CC1CCOCC1.CC
InChIInChI=1S/C8H12O.C2H6/c1-2-3-8-4-6-9-7-5-8;1-2/h3,8H,1,4-7H2;1-2H3
InChIKeyLQYTUTRHOWKEGS-UHFFFAOYSA-N
XLogP2.78
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-Ethenyloxane
CID 12411805
(E)-4-(3,3-dimethylbut-1-en-1-yl)tetrahydro-2H-pyran
CID 126642344
4-Ethenyl-4-propan-2-yloxane
CID 21339067
4-Methyl-4-prop-2-enyloxane
CID 57602800
4-[(E)-but-1-enyl]oxane
CID 57602852
4-Allyltetrahydro-2H-pyran
CID 58023197
4-But-1-enyloxane
CID 76623256
4-(2-Ethylpent-4-enoxymethyl)hex-1-ene
CID 88202218
4-Prop-1-en-2-yloxane
CID 88988807
4-Ethenyl-4-methyloxane
CID 89529214
4-(2-Methylprop-1-enyl)oxane
CID 91047314
4-Ethyl-2-methylideneoxane
CID 122595913

Frequently Asked Questions

What is the IUPAC name of ethane;4-propa-1,2-dienyloxane?
The IUPAC name of ethane;4-propa-1,2-dienyloxane (CID 143862152) is ethane;4-propa-1,2-dienyloxane.
What is the SMILES notation for ethane;4-propa-1,2-dienyloxane?
The canonical SMILES for ethane;4-propa-1,2-dienyloxane is C=C=CC1CCOCC1.CC.
What is the InChIKey of ethane;4-propa-1,2-dienyloxane?
The InChIKey is LQYTUTRHOWKEGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12O.C2H6/c1-2-3-8-4-6-9-7-5-8;1-2/h3,8H,1,4-7H2;1-2H3.
What are the key properties of ethane;4-propa-1,2-dienyloxane?
ethane;4-propa-1,2-dienyloxane has a molecular weight of 154.25 g/mol, XLogP of 2.78, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-propa-1,2-dienyloxane is sourced from PubChem (CID 143862152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).