2-tellurocyanatoethyl 2-methylprop-2-enoate

C7H9NO2Te — CID 87752652

IUPAC2-tellurocyanatoethyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCC[Te]C#N
InChIInChI=1S/C7H9NO2Te/c1-6(2)7(9)10-3-4-11-5-8/h1,3-4H2,2H3
InChIKeyLTYQNTMNUKIAKX-UHFFFAOYSA-N
MW266.75 g/mol
LogP0.71
Rot. Bonds4

About 2-tellurocyanatoethyl 2-methylprop-2-enoate

2-tellurocyanatoethyl 2-methylprop-2-enoate (PubChem CID 87752652) has the molecular formula C7H9NO2Te and a molecular weight of 266.75 g/mol. Its IUPAC name is 2-tellurocyanatoethyl 2-methylprop-2-enoate.

Molecular Properties

Compound Name2-tellurocyanatoethyl 2-methylprop-2-enoate
PubChem CID87752652
Molecular FormulaC7H9NO2Te
Molecular Weight266.75 g/mol
Exact Mass268.97
IUPAC Name2-tellurocyanatoethyl 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OCC[Te]C#N
InChIInChI=1S/C7H9NO2Te/c1-6(2)7(9)10-3-4-11-5-8/h1,3-4H2,2H3
InChIKeyLTYQNTMNUKIAKX-UHFFFAOYSA-N
XLogP0.71
TPSA50.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.75
LogP ≤ 50.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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

ethene;2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate
CID 173009937
azane;propyl 2-methylprop-2-enoate
CID 172812841
2-(3-cyanatopropanoyloxy)ethyl 2-methylprop-2-enoate
CID 129129901
diazanium;2-(2-methylprop-2-enoyloxy)ethylazanium;trichloride
CID 143861724
2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethyl 2-methylprop-2-enoate
CID 7979
2-[2-[2-[2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 2-methylprop-2-enoate
CID 18762112
bis[4-(2-methylprop-2-enoyloxy)butyl] oxalate
CID 118147382
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methylprop-2-enoyloxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl 2-methylprop-2-enoate
CID 139628547
cyanic acid;ethyl 2-methylprop-2-enoate
CID 172737974
2-(2-methylprop-2-enoyloxy)ethyl 4-cyanatobutanoate
CID 129107798
2-cyanoethyl 2-methylprop-2-enoate;3-cyanopropanoic acid
CID 174752045
2-(2-methylprop-2-enoyloxy)ethyl 2-methylprop-2-enoate;nonakis(prop-1-ene)
CID 173068986

Frequently Asked Questions

What is the IUPAC name of 2-tellurocyanatoethyl 2-methylprop-2-enoate?
The IUPAC name of 2-tellurocyanatoethyl 2-methylprop-2-enoate (CID 87752652) is 2-tellurocyanatoethyl 2-methylprop-2-enoate.
What is the SMILES notation for 2-tellurocyanatoethyl 2-methylprop-2-enoate?
The canonical SMILES for 2-tellurocyanatoethyl 2-methylprop-2-enoate is C=C(C)C(=O)OCC[Te]C#N.
What is the InChIKey of 2-tellurocyanatoethyl 2-methylprop-2-enoate?
The InChIKey is LTYQNTMNUKIAKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9NO2Te/c1-6(2)7(9)10-3-4-11-5-8/h1,3-4H2,2H3.
What are the key properties of 2-tellurocyanatoethyl 2-methylprop-2-enoate?
2-tellurocyanatoethyl 2-methylprop-2-enoate has a molecular weight of 266.75 g/mol, XLogP of 0.71, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tellurocyanatoethyl 2-methylprop-2-enoate is sourced from PubChem (CID 87752652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).