(2E,3Z)-2-ethylidene-3-prop-2-enylidenefuran;2-methylpropane

C13H20O — CID 145032587

IUPAC(2E,3Z)-2-ethylidene-3-prop-2-enylidenefuran;2-methylpropane
SMILESC=C/C=c1/cco/c1=C/C.CC(C)C
InChIInChI=1S/C9H10O.C4H10/c1-3-5-8-6-7-10-9(8)4-2;1-4(2)3/h3-7H,1H2,2H3;4H,1-3H3/b8-5-,9-4+;
InChIKeyIOTLSZZCAAESER-HHHUAFAMSA-N
MW192.30 g/mol
LogP2.71
Rot. Bonds1

About (2E,3Z)-2-ethylidene-3-prop-2-enylidenefuran;2-methylpropane

(2E,3Z)-2-ethylidene-3-prop-2-enylidenefuran;2-methylpropane (PubChem CID 145032587) has the molecular formula C13H20O and a molecular weight of 192.30 g/mol. Its IUPAC name is (2E,3Z)-2-ethylidene-3-prop-2-enylidenefuran;2-methylpropane.

Molecular Properties

Compound Name(2E,3Z)-2-ethylidene-3-prop-2-enylidenefuran;2-methylpropane
PubChem CID145032587
Molecular FormulaC13H20O
Molecular Weight192.30 g/mol
Exact Mass192.15
IUPAC Name(2E,3Z)-2-ethylidene-3-prop-2-enylidenefuran;2-methylpropane
SMILESC=C/C=c1/cco/c1=C/C.CC(C)C
InChIInChI=1S/C9H10O.C4H10/c1-3-5-8-6-7-10-9(8)4-2;1-4(2)3/h3-7H,1H2,2H3;4H,1-3H3/b8-5-,9-4+;
InChIKeyIOTLSZZCAAESER-HHHUAFAMSA-N
XLogP2.71
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.30
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(2E,3Z)-2-ethylidene-3-[(Z)-3-iodoprop-2-enylidene]furan
CID 143969399
(5Z,6E)-6-(2-aminopropylidene)-5-prop-2-enylidenepyridin-2-one
CID 87310154
ethane;(5Z,6E)-5-ethylidene-6-prop-2-enylidenepyran-2-one
CID 142874632
ethane;(2E,3Z)-2-ethylidene-3-prop-2-enylidene-1-benzofuran
CID 142403527
(2E,3Z)-2-ethylidene-6-methyl-3-prop-2-enylidenepyridine
CID 143069018
ethane;(2E,3Z)-2-ethylidene-3-prop-2-enylidenepyridine
CID 142972372
CID 162444121
CID 162444121
buta-1,3-diene;2-methylpropane
CID 161376198
(2E,3Z)-5-bromo-2-ethylidene-3-prop-2-enylidene-1-benzofuran
CID 144567617
(3Z,4Z)-4-ethylidene-3-prop-2-enylidenecyclohexa-1,5-diene-1-carbonitrile
CID 146362499
(2E,3Z,4Z,5E)-2,5-di(ethylidene)-3,4-bis(prop-2-enylidene)pyrrolidine
CID 144844231
ethane;methyl (4Z,5E)-5-ethylidene-4-prop-2-enylidene-1H-pyrrole-2-carboxylate
CID 145311762

Frequently Asked Questions

What is the IUPAC name of (2E,3Z)-2-ethylidene-3-prop-2-enylidenefuran;2-methylpropane?
The IUPAC name of (2E,3Z)-2-ethylidene-3-prop-2-enylidenefuran;2-methylpropane (CID 145032587) is (2E,3Z)-2-ethylidene-3-prop-2-enylidenefuran;2-methylpropane.
What is the SMILES notation for (2E,3Z)-2-ethylidene-3-prop-2-enylidenefuran;2-methylpropane?
The canonical SMILES for (2E,3Z)-2-ethylidene-3-prop-2-enylidenefuran;2-methylpropane is C=C/C=c1/cco/c1=C/C.CC(C)C.
What is the InChIKey of (2E,3Z)-2-ethylidene-3-prop-2-enylidenefuran;2-methylpropane?
The InChIKey is IOTLSZZCAAESER-HHHUAFAMSA-N. The full InChI is InChI=1S/C9H10O.C4H10/c1-3-5-8-6-7-10-9(8)4-2;1-4(2)3/h3-7H,1H2,2H3;4H,1-3H3/b8-5-,9-4+;.
What are the key properties of (2E,3Z)-2-ethylidene-3-prop-2-enylidenefuran;2-methylpropane?
(2E,3Z)-2-ethylidene-3-prop-2-enylidenefuran;2-methylpropane has a molecular weight of 192.30 g/mol, XLogP of 2.71, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,3Z)-2-ethylidene-3-prop-2-enylidenefuran;2-methylpropane is sourced from PubChem (CID 145032587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).