fluoroform;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;bis(2-methylprop-2-enoic acid)

C15H27F3O8 — CID 160564072

IUPACfluoroform;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;bis(2-methylprop-2-enoic acid)
SMILESC=C(C)C(=O)O.C=C(C)C(=O)O.FC(F)F.OCCOCCOCCO
InChIInChI=1S/C6H14O4.2C4H6O2.CHF3/c7-1-3-9-5-6-10-4-2-8;2*1-3(2)4(5)6;2-1(3)4/h7-8H,1-6H2;2*1H2,2H3,(H,5,6);1H
InChIKeyQZRRWFRAGBWZEQ-UHFFFAOYSA-N
MW392.37 g/mol
LogP1.48
Rot. Bonds9

About fluoroform;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;bis(2-methylprop-2-enoic acid)

fluoroform;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;bis(2-methylprop-2-enoic acid) (PubChem CID 160564072) has the molecular formula C15H27F3O8 and a molecular weight of 392.37 g/mol. Its IUPAC name is fluoroform;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;bis(2-methylprop-2-enoic acid).

Molecular Properties

Compound Namefluoroform;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;bis(2-methylprop-2-enoic acid)
PubChem CID160564072
Molecular FormulaC15H27F3O8
Molecular Weight392.37 g/mol
Exact Mass392.17
IUPAC Namefluoroform;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;bis(2-methylprop-2-enoic acid)
SMILESC=C(C)C(=O)O.C=C(C)C(=O)O.FC(F)F.OCCOCCOCCO
InChIInChI=1S/C6H14O4.2C4H6O2.CHF3/c7-1-3-9-5-6-10-4-2-8;2*1-3(2)4(5)6;2-1(3)4/h7-8H,1-6H2;2*1H2,2H3,(H,5,6);1H
InChIKeyQZRRWFRAGBWZEQ-UHFFFAOYSA-N
XLogP1.48
TPSA133.52 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.37
LogP ≤ 51.48
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol;2-methylprop-2-enoic acid
CID 88625291
2-[2-(2-hydroxyethoxy)ethoxy]ethanol;2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol;tetrakis(2-methylprop-2-enoic acid)
CID 173364076
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol;2-methylprop-2-enoic acid
CID 88626217
2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol;2-methylprop-2-enoic acid
CID 87059902
acetic acid;2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol;2-methylprop-2-enoic acid
CID 175016263
2-[2-(2-hydroxyethoxy)ethoxy]ethanol;2-hydroxyethyl 2-methylprop-2-enoate;bis(2-methylprop-2-enoic acid)
CID 173303498
bis(2-[2-(2-hydroxyethoxy)ethoxy]ethanol);2-methylbut-2-enoic acid;bis(2-methylprop-2-enoic acid)
CID 174624671
ethane-1,2-diol;2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol;2-methylbut-2-enoic acid;bis(2-methylprop-2-enoic acid)
CID 174938125
2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-1-methoxyethanol;2-methylprop-2-enoic acid
CID 87255356
bis(2-methylprop-2-enoic acid);2-pentoxyethanol
CID 22218874
2-(2-hydroxyethoxy)ethanol;2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol;tetrakis(2-methylprop-2-enoate)
CID 18957552
acetic acid;2-(2-hydroxyethoxy)ethanol
CID 158067636

Frequently Asked Questions

What is the IUPAC name of fluoroform;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;bis(2-methylprop-2-enoic acid)?
The IUPAC name of fluoroform;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;bis(2-methylprop-2-enoic acid) (CID 160564072) is fluoroform;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;bis(2-methylprop-2-enoic acid).
What is the SMILES notation for fluoroform;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;bis(2-methylprop-2-enoic acid)?
The canonical SMILES for fluoroform;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;bis(2-methylprop-2-enoic acid) is C=C(C)C(=O)O.C=C(C)C(=O)O.FC(F)F.OCCOCCOCCO.
What is the InChIKey of fluoroform;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;bis(2-methylprop-2-enoic acid)?
The InChIKey is QZRRWFRAGBWZEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O4.2C4H6O2.CHF3/c7-1-3-9-5-6-10-4-2-8;2*1-3(2)4(5)6;2-1(3)4/h7-8H,1-6H2;2*1H2,2H3,(H,5,6);1H.
What are the key properties of fluoroform;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;bis(2-methylprop-2-enoic acid)?
fluoroform;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;bis(2-methylprop-2-enoic acid) has a molecular weight of 392.37 g/mol, XLogP of 1.48, 9 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for fluoroform;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;bis(2-methylprop-2-enoic acid) is sourced from PubChem (CID 160564072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).