ethane;4-methyl-2-methylideneoxane

C9H18O — CID 143714590

IUPACethane;4-methyl-2-methylideneoxane
SMILESC=C1CC(C)CCO1.CC
InChIInChI=1S/C7H12O.C2H6/c1-6-3-4-8-7(2)5-6;1-2/h6H,2-5H2,1H3;1-2H3
InChIKeyYLFJAHWCPVXQBN-UHFFFAOYSA-N
MW142.24 g/mol
LogP2.97
Rot. Bonds

About ethane;4-methyl-2-methylideneoxane

ethane;4-methyl-2-methylideneoxane (PubChem CID 143714590) has the molecular formula C9H18O and a molecular weight of 142.24 g/mol. Its IUPAC name is ethane;4-methyl-2-methylideneoxane.

Molecular Properties

Compound Nameethane;4-methyl-2-methylideneoxane
PubChem CID143714590
Molecular FormulaC9H18O
Molecular Weight142.24 g/mol
Exact Mass142.14
IUPAC Nameethane;4-methyl-2-methylideneoxane
SMILESC=C1CC(C)CCO1.CC
InChIInChI=1S/C7H12O.C2H6/c1-6-3-4-8-7(2)5-6;1-2/h6H,2-5H2,1H3;1-2H3
InChIKeyYLFJAHWCPVXQBN-UHFFFAOYSA-N
XLogP2.97
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.24
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(r)-5-Ethyl-2-methylene-tetrahydro-pyran
CID 14892305
4,4-Dimethyl-2-methylideneoxane
CID 58763809
Ethyl 1-isopentylvinyl ether
CID 89670721
2-Ethoxy-3-ethyl-5-fluorohex-1-ene
CID 162686841
3-Ethyl-2-methoxypent-1-ene
CID 123530231
5-ethoxy-1,3-bis(prop-2-enyl)-3,4-dihydro-2H-borinine
CID 134890538
3,4,6-Trimethyl-2-methylideneoxane
CID 20614547
2-Ethoxy-4-methylpent-1-ene
CID 20704869
3-Methyl-2-methylideneoxane
CID 20762595
5-Methyl-2-methylideneoxane
CID 21022469
4-Methyl-2-methylideneoxane
CID 58080316
(2R,3R)-2,3-dimethyl-6-methylideneoxane
CID 58223661

Frequently Asked Questions

What is the IUPAC name of ethane;4-methyl-2-methylideneoxane?
The IUPAC name of ethane;4-methyl-2-methylideneoxane (CID 143714590) is ethane;4-methyl-2-methylideneoxane.
What is the SMILES notation for ethane;4-methyl-2-methylideneoxane?
The canonical SMILES for ethane;4-methyl-2-methylideneoxane is C=C1CC(C)CCO1.CC.
What is the InChIKey of ethane;4-methyl-2-methylideneoxane?
The InChIKey is YLFJAHWCPVXQBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12O.C2H6/c1-6-3-4-8-7(2)5-6;1-2/h6H,2-5H2,1H3;1-2H3.
What are the key properties of ethane;4-methyl-2-methylideneoxane?
ethane;4-methyl-2-methylideneoxane has a molecular weight of 142.24 g/mol, XLogP of 2.97, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-methyl-2-methylideneoxane is sourced from PubChem (CID 143714590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).