2-prop-2-enoyloxyethyl prop-2-enoate;zinc

C8H10O4Zn — CID 88622091

IUPAC2-prop-2-enoyloxyethyl prop-2-enoate;zinc
SMILESC=CC(=O)OCCOC(=O)C=C.[Zn]
InChIInChI=1S/C8H10O4.Zn/c1-3-7(9)11-5-6-12-8(10)4-2;/h3-4H,1-2,5-6H2;
InChIKeyKPFGRAFXWPBIAD-UHFFFAOYSA-N
MW235.55 g/mol
LogP0.44
Rot. Bonds5

About 2-prop-2-enoyloxyethyl prop-2-enoate;zinc

2-prop-2-enoyloxyethyl prop-2-enoate;zinc (PubChem CID 88622091) has the molecular formula C8H10O4Zn and a molecular weight of 235.55 g/mol. Its IUPAC name is 2-prop-2-enoyloxyethyl prop-2-enoate;zinc.

Molecular Properties

Compound Name2-prop-2-enoyloxyethyl prop-2-enoate;zinc
PubChem CID88622091
Molecular FormulaC8H10O4Zn
Molecular Weight235.55 g/mol
Exact Mass233.99
IUPAC Name2-prop-2-enoyloxyethyl prop-2-enoate;zinc
SMILESC=CC(=O)OCCOC(=O)C=C.[Zn]
InChIInChI=1S/C8H10O4.Zn/c1-3-7(9)11-5-6-12-8(10)4-2;/h3-4H,1-2,5-6H2;
InChIKeyKPFGRAFXWPBIAD-UHFFFAOYSA-N
XLogP0.44
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.55
LogP ≤ 50.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-prop-2-enoyloxyethylperoxy)ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethylperoxy]ethoxy]ethyl prop-2-enoate
CID 135130326
8-prop-2-enoyloxyoctyl prop-2-enoate
CID 12934232
azane;3-prop-2-enoyloxypropyl prop-2-enoate
CID 162679005
4-prop-2-enoyloxybutyl prop-2-enoate;6-prop-2-enoyloxyhexyl prop-2-enoate
CID 158256375
2-chloroethyl prop-2-enoate;ruthenium
CID 90254573
2-chloroethyl prop-2-enoate
CID 16627
2-[2-[2-[6-[2-[2-(2-prop-2-enoyloxyethoxy)ethoxy]ethoxy]hexoxy]ethoxy]ethoxy]ethyl prop-2-enoate
CID 101134249
2-prop-2-enoyloxyethoxyboronic acid
CID 123659445
2-[bis(2-prop-2-enoyloxyethoxy)phosphoryloxy]ethyl prop-2-enoate
CID 13205776
ethane-1,2-diol;prop-2-enoyl chloride;2-prop-2-enoyloxyethyl prop-2-enoate
CID 160715574
2-[(3E)-hexa-1,3,5-trien-3-yl]oxyethyl prop-2-enoate
CID 154687080
2-prop-2-enoyloxyethyl 2-methylidenebutanoate
CID 57033268

Frequently Asked Questions

What is the IUPAC name of 2-prop-2-enoyloxyethyl prop-2-enoate;zinc?
The IUPAC name of 2-prop-2-enoyloxyethyl prop-2-enoate;zinc (CID 88622091) is 2-prop-2-enoyloxyethyl prop-2-enoate;zinc.
What is the SMILES notation for 2-prop-2-enoyloxyethyl prop-2-enoate;zinc?
The canonical SMILES for 2-prop-2-enoyloxyethyl prop-2-enoate;zinc is C=CC(=O)OCCOC(=O)C=C.[Zn].
What is the InChIKey of 2-prop-2-enoyloxyethyl prop-2-enoate;zinc?
The InChIKey is KPFGRAFXWPBIAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10O4.Zn/c1-3-7(9)11-5-6-12-8(10)4-2;/h3-4H,1-2,5-6H2;.
What are the key properties of 2-prop-2-enoyloxyethyl prop-2-enoate;zinc?
2-prop-2-enoyloxyethyl prop-2-enoate;zinc has a molecular weight of 235.55 g/mol, XLogP of 0.44, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-prop-2-enoyloxyethyl prop-2-enoate;zinc is sourced from PubChem (CID 88622091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).