ethenoxyethene;2-[2-(4-hydroxyphenyl)propan-2-yl]phenol

C19H22O3 — CID 23109868

IUPACethenoxyethene;2-[2-(4-hydroxyphenyl)propan-2-yl]phenol
SMILESC=COC=C.CC(C)(c1ccc(O)cc1)c1ccccc1O
InChIInChI=1S/C15H16O2.C4H6O/c1-15(2,11-7-9-12(16)10-8-11)13-5-3-4-6-14(13)17;1-3-5-4-2/h3-10,16-17H,1-2H3;3-4H,1-2H2
InChIKeyKRURQGBLGXUAQN-UHFFFAOYSA-N
MW298.38 g/mol
LogP4.71
Rot. Bonds4

About ethenoxyethene;2-[2-(4-hydroxyphenyl)propan-2-yl]phenol

ethenoxyethene;2-[2-(4-hydroxyphenyl)propan-2-yl]phenol (PubChem CID 23109868) has the molecular formula C19H22O3 and a molecular weight of 298.38 g/mol. Its IUPAC name is ethenoxyethene;2-[2-(4-hydroxyphenyl)propan-2-yl]phenol.

Molecular Properties

Compound Nameethenoxyethene;2-[2-(4-hydroxyphenyl)propan-2-yl]phenol
PubChem CID23109868
Molecular FormulaC19H22O3
Molecular Weight298.38 g/mol
Exact Mass298.16
IUPAC Nameethenoxyethene;2-[2-(4-hydroxyphenyl)propan-2-yl]phenol
SMILESC=COC=C.CC(C)(c1ccc(O)cc1)c1ccccc1O
InChIInChI=1S/C15H16O2.C4H6O/c1-15(2,11-7-9-12(16)10-8-11)13-5-3-4-6-14(13)17;1-3-5-4-2/h3-10,16-17H,1-2H3;3-4H,1-2H2
InChIKeyKRURQGBLGXUAQN-UHFFFAOYSA-N
XLogP4.71
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.38
LogP ≤ 54.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of ethenoxyethene;2-[2-(4-hydroxyphenyl)propan-2-yl]phenol?
The IUPAC name of ethenoxyethene;2-[2-(4-hydroxyphenyl)propan-2-yl]phenol (CID 23109868) is ethenoxyethene;2-[2-(4-hydroxyphenyl)propan-2-yl]phenol.
What is the SMILES notation for ethenoxyethene;2-[2-(4-hydroxyphenyl)propan-2-yl]phenol?
The canonical SMILES for ethenoxyethene;2-[2-(4-hydroxyphenyl)propan-2-yl]phenol is C=COC=C.CC(C)(c1ccc(O)cc1)c1ccccc1O.
What is the InChIKey of ethenoxyethene;2-[2-(4-hydroxyphenyl)propan-2-yl]phenol?
The InChIKey is KRURQGBLGXUAQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O2.C4H6O/c1-15(2,11-7-9-12(16)10-8-11)13-5-3-4-6-14(13)17;1-3-5-4-2/h3-10,16-17H,1-2H3;3-4H,1-2H2.
What are the key properties of ethenoxyethene;2-[2-(4-hydroxyphenyl)propan-2-yl]phenol?
ethenoxyethene;2-[2-(4-hydroxyphenyl)propan-2-yl]phenol has a molecular weight of 298.38 g/mol, XLogP of 4.71, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethenoxyethene;2-[2-(4-hydroxyphenyl)propan-2-yl]phenol is sourced from PubChem (CID 23109868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).