(4Z)-3,3-dimethyl-4-(4-methylideneoxolan-3-ylidene)oxolane

C11H16O2 — CID 154722824

IUPAC(4Z)-3,3-dimethyl-4-(4-methylideneoxolan-3-ylidene)oxolane
SMILESC=C1COC/C1=C1\COCC1(C)C
InChIInChI=1S/C11H16O2/c1-8-4-12-5-9(8)10-6-13-7-11(10,2)3/h1,4-7H2,2-3H3/b10-9-
InChIKeyJCONQSAJLCKLBH-KTKRTIGZSA-N
MW180.25 g/mol
LogP1.93
Rot. Bonds

About (4Z)-3,3-dimethyl-4-(4-methylideneoxolan-3-ylidene)oxolane

(4Z)-3,3-dimethyl-4-(4-methylideneoxolan-3-ylidene)oxolane (PubChem CID 154722824) has the molecular formula C11H16O2 and a molecular weight of 180.25 g/mol. Its IUPAC name is (4Z)-3,3-dimethyl-4-(4-methylideneoxolan-3-ylidene)oxolane.

Molecular Properties

Compound Name(4Z)-3,3-dimethyl-4-(4-methylideneoxolan-3-ylidene)oxolane
PubChem CID154722824
Molecular FormulaC11H16O2
Molecular Weight180.25 g/mol
Exact Mass180.12
IUPAC Name(4Z)-3,3-dimethyl-4-(4-methylideneoxolan-3-ylidene)oxolane
SMILESC=C1COC/C1=C1\COCC1(C)C
InChIInChI=1S/C11H16O2/c1-8-4-12-5-9(8)10-6-13-7-11(10,2)3/h1,4-7H2,2-3H3/b10-9-
InChIKeyJCONQSAJLCKLBH-KTKRTIGZSA-N
XLogP1.93
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4Z)-3,3-dimethyl-4-(4-methylideneoxolan-3-ylidene)oxolane?
The IUPAC name of (4Z)-3,3-dimethyl-4-(4-methylideneoxolan-3-ylidene)oxolane (CID 154722824) is (4Z)-3,3-dimethyl-4-(4-methylideneoxolan-3-ylidene)oxolane.
What is the SMILES notation for (4Z)-3,3-dimethyl-4-(4-methylideneoxolan-3-ylidene)oxolane?
The canonical SMILES for (4Z)-3,3-dimethyl-4-(4-methylideneoxolan-3-ylidene)oxolane is C=C1COC/C1=C1\COCC1(C)C.
What is the InChIKey of (4Z)-3,3-dimethyl-4-(4-methylideneoxolan-3-ylidene)oxolane?
The InChIKey is JCONQSAJLCKLBH-KTKRTIGZSA-N. The full InChI is InChI=1S/C11H16O2/c1-8-4-12-5-9(8)10-6-13-7-11(10,2)3/h1,4-7H2,2-3H3/b10-9-.
What are the key properties of (4Z)-3,3-dimethyl-4-(4-methylideneoxolan-3-ylidene)oxolane?
(4Z)-3,3-dimethyl-4-(4-methylideneoxolan-3-ylidene)oxolane has a molecular weight of 180.25 g/mol, XLogP of 1.93, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-3,3-dimethyl-4-(4-methylideneoxolan-3-ylidene)oxolane is sourced from PubChem (CID 154722824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).