carbonic acid;diethyl carbonate;ethenyl acetate

C10H18O8 — CID 174977930

IUPACcarbonic acid;diethyl carbonate;ethenyl acetate
SMILESC=COC(C)=O.CCOC(=O)OCC.O=C(O)O
InChIInChI=1S/C5H10O3.C4H6O2.CH2O3/c1-3-7-5(6)8-4-2;1-3-6-4(2)5;2-1(3)4/h3-4H2,1-2H3;3H,1H2,2H3;(H2,2,3,4)
InChIKeyRYLVCQRFJQKVPU-UHFFFAOYSA-N
MW266.25 g/mol
LogP2.09
Rot. Bonds3

About carbonic acid;diethyl carbonate;ethenyl acetate

carbonic acid;diethyl carbonate;ethenyl acetate (PubChem CID 174977930) has the molecular formula C10H18O8 and a molecular weight of 266.25 g/mol. Its IUPAC name is carbonic acid;diethyl carbonate;ethenyl acetate.

Molecular Properties

Compound Namecarbonic acid;diethyl carbonate;ethenyl acetate
PubChem CID174977930
Molecular FormulaC10H18O8
Molecular Weight266.25 g/mol
Exact Mass266.10
IUPAC Namecarbonic acid;diethyl carbonate;ethenyl acetate
SMILESC=COC(C)=O.CCOC(=O)OCC.O=C(O)O
InChIInChI=1S/C5H10O3.C4H6O2.CH2O3/c1-3-7-5(6)8-4-2;1-3-6-4(2)5;2-1(3)4/h3-4H2,1-2H3;3H,1H2,2H3;(H2,2,3,4)
InChIKeyRYLVCQRFJQKVPU-UHFFFAOYSA-N
XLogP2.09
TPSA119.36 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.25
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of carbonic acid;diethyl carbonate;ethenyl acetate?
The IUPAC name of carbonic acid;diethyl carbonate;ethenyl acetate (CID 174977930) is carbonic acid;diethyl carbonate;ethenyl acetate.
What is the SMILES notation for carbonic acid;diethyl carbonate;ethenyl acetate?
The canonical SMILES for carbonic acid;diethyl carbonate;ethenyl acetate is C=COC(C)=O.CCOC(=O)OCC.O=C(O)O.
What is the InChIKey of carbonic acid;diethyl carbonate;ethenyl acetate?
The InChIKey is RYLVCQRFJQKVPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10O3.C4H6O2.CH2O3/c1-3-7-5(6)8-4-2;1-3-6-4(2)5;2-1(3)4/h3-4H2,1-2H3;3H,1H2,2H3;(H2,2,3,4).
What are the key properties of carbonic acid;diethyl carbonate;ethenyl acetate?
carbonic acid;diethyl carbonate;ethenyl acetate has a molecular weight of 266.25 g/mol, XLogP of 2.09, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for carbonic acid;diethyl carbonate;ethenyl acetate is sourced from PubChem (CID 174977930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).