carbonic acid;3-(2-prop-2-enoxyethoxy)prop-1-ene

C10H18O8 — CID 88663194

IUPACcarbonic acid;3-(2-prop-2-enoxyethoxy)prop-1-ene
SMILESC=CCOCCOCC=C.O=C(O)O.O=C(O)O
InChIInChI=1S/C8H14O2.2CH2O3/c1-3-5-9-7-8-10-6-4-2;2*2-1(3)4/h3-4H,1-2,5-8H2;2*(H2,2,3,4)
InChIKeyXHTJFJKJOLOBNV-UHFFFAOYSA-N
MW266.25 g/mol
LogP1.84
Rot. Bonds7

About carbonic acid;3-(2-prop-2-enoxyethoxy)prop-1-ene

carbonic acid;3-(2-prop-2-enoxyethoxy)prop-1-ene (PubChem CID 88663194) has the molecular formula C10H18O8 and a molecular weight of 266.25 g/mol. Its IUPAC name is carbonic acid;3-(2-prop-2-enoxyethoxy)prop-1-ene.

Molecular Properties

Compound Namecarbonic acid;3-(2-prop-2-enoxyethoxy)prop-1-ene
PubChem CID88663194
Molecular FormulaC10H18O8
Molecular Weight266.25 g/mol
Exact Mass266.10
IUPAC Namecarbonic acid;3-(2-prop-2-enoxyethoxy)prop-1-ene
SMILESC=CCOCCOCC=C.O=C(O)O.O=C(O)O
InChIInChI=1S/C8H14O2.2CH2O3/c1-3-5-9-7-8-10-6-4-2;2*2-1(3)4/h3-4H,1-2,5-8H2;2*(H2,2,3,4)
InChIKeyXHTJFJKJOLOBNV-UHFFFAOYSA-N
XLogP1.84
TPSA133.52 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.25
LogP ≤ 51.84
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-(2-prop-2-enoxyethoxy)propanoic acid
CID 59615985
3-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-prop-2-enoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]prop-1-ene
CID 58112303
carbonic acid;prop-1-ene;3-prop-2-enoxyprop-1-ene
CID 87667724
(Z)-2,3-bis(2-prop-2-enoxyethyl)but-2-enedioic acid
CID 87907492
2-[2-[2-(2-prop-2-enoxyethoxy)ethoxy]ethoxy]ethyl acetate
CID 525183
2-(2-prop-2-enoxyethoxy)ethyl acetate
CID 525147
2-[2-(2-prop-2-enoxyethoxy)ethoxy]propanoic acid
CID 86708289
2-[2-[2-[2-[2-[2-[2-(2-prop-2-enoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 14619770
2-[2-[2-[2-[2-[2-(2-prop-2-enoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 14619769
2-prop-2-enoxyethyl 2,2-dimethylpropanoate
CID 89277080
2-oxo-4-prop-2-enoxybutanal
CID 142662076
2-[2-[2-[2-[2-(2-prop-2-enoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol;sulfuric acid
CID 88726836

Frequently Asked Questions

What is the IUPAC name of carbonic acid;3-(2-prop-2-enoxyethoxy)prop-1-ene?
The IUPAC name of carbonic acid;3-(2-prop-2-enoxyethoxy)prop-1-ene (CID 88663194) is carbonic acid;3-(2-prop-2-enoxyethoxy)prop-1-ene.
What is the SMILES notation for carbonic acid;3-(2-prop-2-enoxyethoxy)prop-1-ene?
The canonical SMILES for carbonic acid;3-(2-prop-2-enoxyethoxy)prop-1-ene is C=CCOCCOCC=C.O=C(O)O.O=C(O)O.
What is the InChIKey of carbonic acid;3-(2-prop-2-enoxyethoxy)prop-1-ene?
The InChIKey is XHTJFJKJOLOBNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O2.2CH2O3/c1-3-5-9-7-8-10-6-4-2;2*2-1(3)4/h3-4H,1-2,5-8H2;2*(H2,2,3,4).
What are the key properties of carbonic acid;3-(2-prop-2-enoxyethoxy)prop-1-ene?
carbonic acid;3-(2-prop-2-enoxyethoxy)prop-1-ene has a molecular weight of 266.25 g/mol, XLogP of 1.84, 7 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for carbonic acid;3-(2-prop-2-enoxyethoxy)prop-1-ene is sourced from PubChem (CID 88663194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).