4-methyl-2-methylideneoxane

C7H12O — CID 58080316

IUPAC4-methyl-2-methylideneoxane
SMILESC=C1CC(C)CCO1
InChIInChI=1S/C7H12O/c1-6-3-4-8-7(2)5-6/h6H,2-5H2,1H3
InChIKeyJVSSNJWMOYLKHO-UHFFFAOYSA-N
MW112.17 g/mol
LogP1.95
Rot. Bonds

About 4-methyl-2-methylideneoxane

4-methyl-2-methylideneoxane (PubChem CID 58080316) has the molecular formula C7H12O and a molecular weight of 112.17 g/mol. Its IUPAC name is 4-methyl-2-methylideneoxane.

Molecular Properties

Compound Name4-methyl-2-methylideneoxane
PubChem CID58080316
Molecular FormulaC7H12O
Molecular Weight112.17 g/mol
Exact Mass112.09
IUPAC Name4-methyl-2-methylideneoxane
SMILESC=C1CC(C)CCO1
InChIInChI=1S/C7H12O/c1-6-3-4-8-7(2)5-6/h6H,2-5H2,1H3
InChIKeyJVSSNJWMOYLKHO-UHFFFAOYSA-N
XLogP1.95
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.17
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Methylenetetrahydropyran
CID 11073351
4-Ethenyloxane
CID 12411805
(r)-5-Ethyl-2-methylene-tetrahydro-pyran
CID 14892305
4,4-Dimethyl-2-methylideneoxane
CID 58763809
3-Methyl-2-methylideneoxane
CID 20762595
5-Methyl-2-methylideneoxane
CID 21022469
(2R,3R)-2,3-dimethyl-6-methylideneoxane
CID 58223661
4,4-dimethyl-6-methylidene-3,5-dihydro-2H-pyran-3-ide;bis(yttrium)
CID 58763808
2,3-Dimethyl-5-methylideneoxolane
CID 67949105
2,3-Dimethyl-6-methylideneoxane
CID 76707743
4-(1-propen-2-yl)tetrahydro-2H-pyran
CID 88988807
(2S,4R)-2,4-dimethyl-6-methylideneoxane
CID 89243381

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-methylideneoxane?
The IUPAC name of 4-methyl-2-methylideneoxane (CID 58080316) is 4-methyl-2-methylideneoxane.
What is the SMILES notation for 4-methyl-2-methylideneoxane?
The canonical SMILES for 4-methyl-2-methylideneoxane is C=C1CC(C)CCO1.
What is the InChIKey of 4-methyl-2-methylideneoxane?
The InChIKey is JVSSNJWMOYLKHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12O/c1-6-3-4-8-7(2)5-6/h6H,2-5H2,1H3.
What are the key properties of 4-methyl-2-methylideneoxane?
4-methyl-2-methylideneoxane has a molecular weight of 112.17 g/mol, XLogP of 1.95, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-methylideneoxane is sourced from PubChem (CID 58080316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).