3-ethenyl-4-(2-ethenyl-5-propan-2-yloxyphenyl)phenol

C19H20O2 — CID 126487461

IUPAC3-ethenyl-4-(2-ethenyl-5-propan-2-yloxyphenyl)phenol
SMILESC=Cc1cc(O)ccc1-c1cc(OC(C)C)ccc1C=C
InChIInChI=1S/C19H20O2/c1-5-14-7-9-17(21-13(3)4)12-19(14)18-10-8-16(20)11-15(18)6-2/h5-13,20H,1-2H2,3-4H3
InChIKeyWZIWDVYBVSCLDD-UHFFFAOYSA-N
MW280.37 g/mol
LogP5.13
Rot. Bonds5

About 3-ethenyl-4-(2-ethenyl-5-propan-2-yloxyphenyl)phenol

3-ethenyl-4-(2-ethenyl-5-propan-2-yloxyphenyl)phenol (PubChem CID 126487461) has the molecular formula C19H20O2 and a molecular weight of 280.37 g/mol. Its IUPAC name is 3-ethenyl-4-(2-ethenyl-5-propan-2-yloxyphenyl)phenol.

Molecular Properties

Compound Name3-ethenyl-4-(2-ethenyl-5-propan-2-yloxyphenyl)phenol
PubChem CID126487461
Molecular FormulaC19H20O2
Molecular Weight280.37 g/mol
Exact Mass280.15
IUPAC Name3-ethenyl-4-(2-ethenyl-5-propan-2-yloxyphenyl)phenol
SMILESC=Cc1cc(O)ccc1-c1cc(OC(C)C)ccc1C=C
InChIInChI=1S/C19H20O2/c1-5-14-7-9-17(21-13(3)4)12-19(14)18-10-8-16(20)11-15(18)6-2/h5-13,20H,1-2H2,3-4H3
InChIKeyWZIWDVYBVSCLDD-UHFFFAOYSA-N
XLogP5.13
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500280.37
LogP ≤ 55.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-ethenyl-2-fluoro-4-propan-2-yloxybenzene
CID 175665867
1-ethenyl-4-propan-2-yloxy-2-(trifluoromethyl)benzene
CID 175665810
4-ethenylphenol;1-ethenyl-4-propan-2-yloxybenzene
CID 67420429
(E)-3-(2-ethenyl-4-propan-2-yloxyphenyl)prop-2-enoic acid
CID 66845513
ethane;4-propan-2-yloxyphenol
CID 142348653
(4-ethenyl-3-hydroxyphenyl) acetate
CID 130034523
2,5-di(propan-2-yloxy)phenol
CID 57426094
benzene-1,3-diol;3-propan-2-yloxyphenol
CID 159090607
2,3-dichloro-6-propan-2-yloxyquinoxaline
CID 142745885
5-[(2-hydroxy-4-propan-2-yloxyphenyl)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
CID 168599031
2-ethenyl-3-propan-2-yloxynaphthalene;2-propan-2-yloxynaphthalene
CID 173224247
4-ethenylbenzene-1,3-diol
CID 10374511

Frequently Asked Questions

What is the IUPAC name of 3-ethenyl-4-(2-ethenyl-5-propan-2-yloxyphenyl)phenol?
The IUPAC name of 3-ethenyl-4-(2-ethenyl-5-propan-2-yloxyphenyl)phenol (CID 126487461) is 3-ethenyl-4-(2-ethenyl-5-propan-2-yloxyphenyl)phenol.
What is the SMILES notation for 3-ethenyl-4-(2-ethenyl-5-propan-2-yloxyphenyl)phenol?
The canonical SMILES for 3-ethenyl-4-(2-ethenyl-5-propan-2-yloxyphenyl)phenol is C=Cc1cc(O)ccc1-c1cc(OC(C)C)ccc1C=C.
What is the InChIKey of 3-ethenyl-4-(2-ethenyl-5-propan-2-yloxyphenyl)phenol?
The InChIKey is WZIWDVYBVSCLDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20O2/c1-5-14-7-9-17(21-13(3)4)12-19(14)18-10-8-16(20)11-15(18)6-2/h5-13,20H,1-2H2,3-4H3.
What are the key properties of 3-ethenyl-4-(2-ethenyl-5-propan-2-yloxyphenyl)phenol?
3-ethenyl-4-(2-ethenyl-5-propan-2-yloxyphenyl)phenol has a molecular weight of 280.37 g/mol, XLogP of 5.13, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenyl-4-(2-ethenyl-5-propan-2-yloxyphenyl)phenol is sourced from PubChem (CID 126487461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).