2-ethenyl-2,4,4-trimethyl-5-methylideneoxolane

C10H16O — CID 71368471

IUPAC2-ethenyl-2,4,4-trimethyl-5-methylideneoxolane
SMILESC=CC1(C)CC(C)(C)C(=C)O1
InChIInChI=1S/C10H16O/c1-6-10(5)7-9(3,4)8(2)11-10/h6H,1-2,7H2,3-5H3
InChIKeyTUXSBXSSLJIGJA-UHFFFAOYSA-N
MW152.24 g/mol
LogP2.89
Rot. Bonds1

About 2-ethenyl-2,4,4-trimethyl-5-methylideneoxolane

2-ethenyl-2,4,4-trimethyl-5-methylideneoxolane (PubChem CID 71368471) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is 2-ethenyl-2,4,4-trimethyl-5-methylideneoxolane.

Molecular Properties

Compound Name2-ethenyl-2,4,4-trimethyl-5-methylideneoxolane
PubChem CID71368471
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name2-ethenyl-2,4,4-trimethyl-5-methylideneoxolane
SMILESC=CC1(C)CC(C)(C)C(=C)O1
InChIInChI=1S/C10H16O/c1-6-10(5)7-9(3,4)8(2)11-10/h6H,1-2,7H2,3-5H3
InChIKeyTUXSBXSSLJIGJA-UHFFFAOYSA-N
XLogP2.89
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(3R,4aR,7aS)-3-ethenyl-7a-hydroxy-3,4a-dimethyl-6,7-dihydro-4H-cyclopenta[c][1,2]dioxin-5-one
CID 135069048
2-(2-ethenyl-2-methyl-3H-furan-5-yl)propanal
CID 11240691
3'-ethenyl-3',4-dimethylspiro[1,4-benzothiazine-2,5'-dioxolane]-3-one
CID 10683938
(2R)-2-ethenyl-2-methyl-3-methylideneoxolane
CID 163379901
2,4,6-tris(ethenyl)-2,3,3,4,6-pentamethyloxatrisilinane
CID 68659565
6-chloro-2-ethenyl-2-methyl-3,4-dihydrochromene
CID 121007981
2-ethenyl-2,3,3-trimethyl-1,4-dioxane
CID 142971645
(5S)-5-ethenyl-5-methyloxolan-2-ol
CID 15241028
(2Z)-2-ethylidene-1,1,4,4-tetramethyl-3-methylidenecyclopentane
CID 174030906
(2S)-2-ethenyl-2-methyl-6-propan-2-yl-3,4-dihydrochromene
CID 102455266
4,4,5,5-tetramethyl-2-methylidene-1,3-dioxolane
CID 12643493
3-ethenyl-3-methyldioxirane
CID 91589551

Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-2,4,4-trimethyl-5-methylideneoxolane?
The IUPAC name of 2-ethenyl-2,4,4-trimethyl-5-methylideneoxolane (CID 71368471) is 2-ethenyl-2,4,4-trimethyl-5-methylideneoxolane.
What is the SMILES notation for 2-ethenyl-2,4,4-trimethyl-5-methylideneoxolane?
The canonical SMILES for 2-ethenyl-2,4,4-trimethyl-5-methylideneoxolane is C=CC1(C)CC(C)(C)C(=C)O1.
What is the InChIKey of 2-ethenyl-2,4,4-trimethyl-5-methylideneoxolane?
The InChIKey is TUXSBXSSLJIGJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O/c1-6-10(5)7-9(3,4)8(2)11-10/h6H,1-2,7H2,3-5H3.
What are the key properties of 2-ethenyl-2,4,4-trimethyl-5-methylideneoxolane?
2-ethenyl-2,4,4-trimethyl-5-methylideneoxolane has a molecular weight of 152.24 g/mol, XLogP of 2.89, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-2,4,4-trimethyl-5-methylideneoxolane is sourced from PubChem (CID 71368471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).