[(1Z)-2-(2-methylprop-2-enoyloxymethyl)cyclodecen-1-yl]methyl 2-methylprop-2-enoate

C20H30O4 — CID 118047267

IUPAC[(1Z)-2-(2-methylprop-2-enoyloxymethyl)cyclodecen-1-yl]methyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OC/C1=C(\COC(=O)C(=C)C)CCCCCCCC1
InChIInChI=1S/C20H30O4/c1-15(2)19(21)23-13-17-11-9-7-5-6-8-10-12-18(17)14-24-20(22)16(3)4/h1,3,5-14H2,2,4H3/b18-17-
InChIKeyUAFFCCCARBUYDP-ZCXUNETKSA-N
MW334.46 g/mol
LogP4.66
Rot. Bonds6

About [(1Z)-2-(2-methylprop-2-enoyloxymethyl)cyclodecen-1-yl]methyl 2-methylprop-2-enoate

[(1Z)-2-(2-methylprop-2-enoyloxymethyl)cyclodecen-1-yl]methyl 2-methylprop-2-enoate (PubChem CID 118047267) has the molecular formula C20H30O4 and a molecular weight of 334.46 g/mol. Its IUPAC name is [(1Z)-2-(2-methylprop-2-enoyloxymethyl)cyclodecen-1-yl]methyl 2-methylprop-2-enoate.

Molecular Properties

Compound Name[(1Z)-2-(2-methylprop-2-enoyloxymethyl)cyclodecen-1-yl]methyl 2-methylprop-2-enoate
PubChem CID118047267
Molecular FormulaC20H30O4
Molecular Weight334.46 g/mol
Exact Mass334.21
IUPAC Name[(1Z)-2-(2-methylprop-2-enoyloxymethyl)cyclodecen-1-yl]methyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OC/C1=C(\COC(=O)C(=C)C)CCCCCCCC1
InChIInChI=1S/C20H30O4/c1-15(2)19(21)23-13-17-11-9-7-5-6-8-10-12-18(17)14-24-20(22)16(3)4/h1,3,5-14H2,2,4H3/b18-17-
InChIKeyUAFFCCCARBUYDP-ZCXUNETKSA-N
XLogP4.66
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.46
LogP ≤ 54.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

butyl 2-methylprop-2-enoate;cyclohexanone
CID 67714172
(4-ethenylphenyl)methyl 2-methylprop-2-enoate
CID 14794067
[6-(2-methylprop-2-enoyloxymethyl)naphthalen-2-yl]methyl 2-methylprop-2-enoate
CID 14047796
[4-(2-hydroxyethyl)phenyl]methyl 2-methylprop-2-enoate
CID 139641232
(1,3,4,5,6-pentamethyl-2-bicyclo[2.2.0]hexa-2,5-dienyl)methyl 2-methylprop-2-enoate
CID 21020518
[7-(2-methylprop-2-enoyloxymethyl)naphthalen-2-yl]methyl 2-methylprop-2-enoate
CID 139921074
ethene;2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate
CID 173009937
ethyl 2-methylprop-2-enoate
CID 130475774
hydroxymethyl 2-methylprop-2-enoate
CID 159274421
cyclobutane;2-methylprop-2-eneperoxoic acid
CID 174582061
2-hydroxyethyl 2-methylprop-2-enoate;methane;oxepan-2-one
CID 158521926
[4-[4-(2-methylprop-2-enoyloxymethyl)phenyl]sulfonylphenyl]methyl 2-methylprop-2-enoate
CID 156621377

Frequently Asked Questions

What is the IUPAC name of [(1Z)-2-(2-methylprop-2-enoyloxymethyl)cyclodecen-1-yl]methyl 2-methylprop-2-enoate?
The IUPAC name of [(1Z)-2-(2-methylprop-2-enoyloxymethyl)cyclodecen-1-yl]methyl 2-methylprop-2-enoate (CID 118047267) is [(1Z)-2-(2-methylprop-2-enoyloxymethyl)cyclodecen-1-yl]methyl 2-methylprop-2-enoate.
What is the SMILES notation for [(1Z)-2-(2-methylprop-2-enoyloxymethyl)cyclodecen-1-yl]methyl 2-methylprop-2-enoate?
The canonical SMILES for [(1Z)-2-(2-methylprop-2-enoyloxymethyl)cyclodecen-1-yl]methyl 2-methylprop-2-enoate is C=C(C)C(=O)OC/C1=C(\COC(=O)C(=C)C)CCCCCCCC1.
What is the InChIKey of [(1Z)-2-(2-methylprop-2-enoyloxymethyl)cyclodecen-1-yl]methyl 2-methylprop-2-enoate?
The InChIKey is UAFFCCCARBUYDP-ZCXUNETKSA-N. The full InChI is InChI=1S/C20H30O4/c1-15(2)19(21)23-13-17-11-9-7-5-6-8-10-12-18(17)14-24-20(22)16(3)4/h1,3,5-14H2,2,4H3/b18-17-.
What are the key properties of [(1Z)-2-(2-methylprop-2-enoyloxymethyl)cyclodecen-1-yl]methyl 2-methylprop-2-enoate?
[(1Z)-2-(2-methylprop-2-enoyloxymethyl)cyclodecen-1-yl]methyl 2-methylprop-2-enoate has a molecular weight of 334.46 g/mol, XLogP of 4.66, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(1Z)-2-(2-methylprop-2-enoyloxymethyl)cyclodecen-1-yl]methyl 2-methylprop-2-enoate is sourced from PubChem (CID 118047267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).