2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate;2-[2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethoxy]ethyl prop-2-enoate

C24H36O11 — CID 160886159

IUPAC2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate;2-[2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethoxy]ethyl prop-2-enoate
SMILESC=C(C)C(=O)OCCOC(=O)C(=C)C.C=CC(=O)OCCOCCOCCOCCOC(=O)C=C
InChIInChI=1S/C14H22O7.C10H14O4/c1-3-13(15)20-11-9-18-7-5-17-6-8-19-10-12-21-14(16)4-2;1-7(2)9(11)13-5-6-14-10(12)8(3)4/h3-4H,1-2,5-12H2;1,3,5-6H2,2,4H3
InChIKeySNQWFWZPUXLKJD-UHFFFAOYSA-N
MW500.54 g/mol
LogP1.72
Rot. Bonds19

About 2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate;2-[2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethoxy]ethyl prop-2-enoate

2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate;2-[2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethoxy]ethyl prop-2-enoate (PubChem CID 160886159) has the molecular formula C24H36O11 and a molecular weight of 500.54 g/mol. Its IUPAC name is 2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate;2-[2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethoxy]ethyl prop-2-enoate.

Molecular Properties

Compound Name2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate;2-[2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethoxy]ethyl prop-2-enoate
PubChem CID160886159
Molecular FormulaC24H36O11
Molecular Weight500.54 g/mol
Exact Mass500.23
IUPAC Name2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate;2-[2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethoxy]ethyl prop-2-enoate
SMILESC=C(C)C(=O)OCCOC(=O)C(=C)C.C=CC(=O)OCCOCCOCCOCCOC(=O)C=C
InChIInChI=1S/C14H22O7.C10H14O4/c1-3-13(15)20-11-9-18-7-5-17-6-8-19-10-12-21-14(16)4-2;1-7(2)9(11)13-5-6-14-10(12)8(3)4/h3-4H,1-2,5-12H2;1,3,5-6H2,2,4H3
InChIKeySNQWFWZPUXLKJD-UHFFFAOYSA-N
XLogP1.72
TPSA132.89 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds19
Heavy Atoms35
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500500.54
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate;2-[2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethoxy]ethyl prop-2-enoate?
The IUPAC name of 2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate;2-[2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethoxy]ethyl prop-2-enoate (CID 160886159) is 2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate;2-[2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethoxy]ethyl prop-2-enoate.
What is the SMILES notation for 2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate;2-[2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethoxy]ethyl prop-2-enoate?
The canonical SMILES for 2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate;2-[2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethoxy]ethyl prop-2-enoate is C=C(C)C(=O)OCCOC(=O)C(=C)C.C=CC(=O)OCCOCCOCCOCCOC(=O)C=C.
What is the InChIKey of 2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate;2-[2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethoxy]ethyl prop-2-enoate?
The InChIKey is SNQWFWZPUXLKJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O7.C10H14O4/c1-3-13(15)20-11-9-18-7-5-17-6-8-19-10-12-21-14(16)4-2;1-7(2)9(11)13-5-6-14-10(12)8(3)4/h3-4H,1-2,5-12H2;1,3,5-6H2,2,4H3.
What are the key properties of 2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate;2-[2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethoxy]ethyl prop-2-enoate?
2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate;2-[2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethoxy]ethyl prop-2-enoate has a molecular weight of 500.54 g/mol, XLogP of 1.72, 19 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate;2-[2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethoxy]ethyl prop-2-enoate is sourced from PubChem (CID 160886159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).