2-[4-[2-(2-Methylprop-2-enoyloxy)ethoxy]cyclohexyl]oxyethyl 2-methylprop-2-enoate

C18H28O6 — CID 14692691

IUPAC2-[4-[2-(2-methylprop-2-enoyloxy)ethoxy]cyclohexyl]oxyethyl 2-methylprop-2-enoate
SMILESCC(=C)C(=O)OCCOC1CCC(CC1)OCCOC(=O)C(=C)C
InChIInChI=1S/C18H28O6/c1-13(2)17(19)23-11-9-21-15-5-7-16(8-6-15)22-10-12-24-18(20)14(3)4/h15-16H,1,3,5-12H2,2,4H3
InChIKeyDPVBRCGAPXNEIL-UHFFFAOYSA-N
MW340.40 g/mol
LogP3.00
Rot. Bonds12

About 2-[4-[2-(2-Methylprop-2-enoyloxy)ethoxy]cyclohexyl]oxyethyl 2-methylprop-2-enoate

2-[4-[2-(2-Methylprop-2-enoyloxy)ethoxy]cyclohexyl]oxyethyl 2-methylprop-2-enoate (PubChem CID 14692691) has the molecular formula C18H28O6 and a molecular weight of 340.40 g/mol. Its IUPAC name is 2-[4-[2-(2-methylprop-2-enoyloxy)ethoxy]cyclohexyl]oxyethyl 2-methylprop-2-enoate.

Molecular Properties

Compound Name2-[4-[2-(2-Methylprop-2-enoyloxy)ethoxy]cyclohexyl]oxyethyl 2-methylprop-2-enoate
PubChem CID14692691
Molecular FormulaC18H28O6
Molecular Weight340.40 g/mol
Exact Mass340.19
IUPAC Name2-[4-[2-(2-methylprop-2-enoyloxy)ethoxy]cyclohexyl]oxyethyl 2-methylprop-2-enoate
SMILESCC(=C)C(=O)OCCOC1CCC(CC1)OCCOC(=O)C(=C)C
InChIInChI=1S/C18H28O6/c1-13(2)17(19)23-11-9-21-15-5-7-16(8-6-15)22-10-12-24-18(20)14(3)4/h15-16H,1,3,5-12H2,2,4H3
InChIKeyDPVBRCGAPXNEIL-UHFFFAOYSA-N
XLogP3.00
TPSA71.10 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms24
Complexity406

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.40
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

Cyclohexyl methacrylate
CID 7561
Chma mma
CID 19098032
1,4-Cyclohexanediol dimethacrylate
CID 20156022
2-Propenoic acid, 2-methyl-, (tetrahydro-2H-pyran-2-yl)methyl ester
CID 112068
Cyclohexyl 2-methylprop-2-enoate;2-hydroxyethyl 2-methylprop-2-enoate
CID 69069752
Cyclohexyl 2-methylprop-2-enoate;2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate
CID 70601226
Cyclohexyl 2-methylprop-2-enoate;oxiran-2-ylmethyl 2-methylprop-2-enoate
CID 88372918
Butyl prop-2-enoate;cyclohexyl 2-methylprop-2-enoate;methyl 2-methylprop-2-enoate
CID 89953705
trans-1,2-Di(methacryloxy)cyclohexane
CID 129761364
Hexane-2,5-diyl bis(2-methylprop-2-enoate)
CID 22238526
4-O-cyclohexyl 1-O-[2-(2-methylprop-2-enoyloxy)ethyl] 2,2-difluorobutanedioate
CID 68052296
[2-[4-[2-(2,2,3,3,4,4,4-Heptafluorobutoxy)-2-oxoethoxy]cyclohexyl]oxy-2-oxoethyl] 2-methylprop-2-enoate
CID 121323926

Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-(2-Methylprop-2-enoyloxy)ethoxy]cyclohexyl]oxyethyl 2-methylprop-2-enoate?
The IUPAC name of 2-[4-[2-(2-Methylprop-2-enoyloxy)ethoxy]cyclohexyl]oxyethyl 2-methylprop-2-enoate (CID 14692691) is 2-[4-[2-(2-methylprop-2-enoyloxy)ethoxy]cyclohexyl]oxyethyl 2-methylprop-2-enoate.
What is the SMILES notation for 2-[4-[2-(2-Methylprop-2-enoyloxy)ethoxy]cyclohexyl]oxyethyl 2-methylprop-2-enoate?
The canonical SMILES for 2-[4-[2-(2-Methylprop-2-enoyloxy)ethoxy]cyclohexyl]oxyethyl 2-methylprop-2-enoate is CC(=C)C(=O)OCCOC1CCC(CC1)OCCOC(=O)C(=C)C.
What is the InChIKey of 2-[4-[2-(2-Methylprop-2-enoyloxy)ethoxy]cyclohexyl]oxyethyl 2-methylprop-2-enoate?
The InChIKey is DPVBRCGAPXNEIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28O6/c1-13(2)17(19)23-11-9-21-15-5-7-16(8-6-15)22-10-12-24-18(20)14(3)4/h15-16H,1,3,5-12H2,2,4H3.
What are the key properties of 2-[4-[2-(2-Methylprop-2-enoyloxy)ethoxy]cyclohexyl]oxyethyl 2-methylprop-2-enoate?
2-[4-[2-(2-Methylprop-2-enoyloxy)ethoxy]cyclohexyl]oxyethyl 2-methylprop-2-enoate has a molecular weight of 340.40 g/mol, XLogP of 3.00, 12 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-(2-Methylprop-2-enoyloxy)ethoxy]cyclohexyl]oxyethyl 2-methylprop-2-enoate is sourced from PubChem (CID 14692691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).