4-(4-hydroxy-2-methyl-5-prop-2-enylphenyl)-5-methyl-2-prop-2-enylphenol

C20H22O2 — CID 54433702

IUPAC4-(4-hydroxy-2-methyl-5-prop-2-enylphenyl)-5-methyl-2-prop-2-enylphenol
SMILESC=CCc1cc(-c2cc(CC=C)c(O)cc2C)c(C)cc1O
InChIInChI=1S/C20H22O2/c1-5-7-15-11-17(13(3)9-19(15)21)18-12-16(8-6-2)20(22)10-14(18)4/h5-6,9-12,21-22H,1-2,7-8H2,3-4H3
InChIKeyWJGUYRGCRSAPRV-UHFFFAOYSA-N
MW294.39 g/mol
LogP4.84
Rot. Bonds5

About 4-(4-hydroxy-2-methyl-5-prop-2-enylphenyl)-5-methyl-2-prop-2-enylphenol

4-(4-hydroxy-2-methyl-5-prop-2-enylphenyl)-5-methyl-2-prop-2-enylphenol (PubChem CID 54433702) has the molecular formula C20H22O2 and a molecular weight of 294.39 g/mol. Its IUPAC name is 4-(4-hydroxy-2-methyl-5-prop-2-enylphenyl)-5-methyl-2-prop-2-enylphenol.

Molecular Properties

Compound Name4-(4-hydroxy-2-methyl-5-prop-2-enylphenyl)-5-methyl-2-prop-2-enylphenol
PubChem CID54433702
Molecular FormulaC20H22O2
Molecular Weight294.39 g/mol
Exact Mass294.16
IUPAC Name4-(4-hydroxy-2-methyl-5-prop-2-enylphenyl)-5-methyl-2-prop-2-enylphenol
SMILESC=CCc1cc(-c2cc(CC=C)c(O)cc2C)c(C)cc1O
InChIInChI=1S/C20H22O2/c1-5-7-15-11-17(13(3)9-19(15)21)18-12-16(8-6-2)20(22)10-14(18)4/h5-6,9-12,21-22H,1-2,7-8H2,3-4H3
InChIKeyWJGUYRGCRSAPRV-UHFFFAOYSA-N
XLogP4.84
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.39
LogP ≤ 54.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-bromo-5-methyl-2-prop-2-enylphenol
CID 142719301
4-methyl-5-prop-2-enylbenzene-1,2-diol
CID 12635732
2,4,5-tris(prop-2-enyl)phenol
CID 20562879
2-amino-5-methyl-4-prop-2-enylphenol
CID 163979621
4-methoxy-6-prop-2-enylbenzene-1,3-diol
CID 15775117
2-fluoro-3-methyl-6-prop-2-enylphenol
CID 107657766
4-hydroxy-3-methyl-5-prop-2-enylbenzaldehyde
CID 59720398
5-methoxy-2-prop-2-enylphenol
CID 6424515
4-[9-(4-hydroxy-3-prop-2-enylphenyl)fluoren-9-yl]-2-methylphenol
CID 69497823
2-(4,5-dimethyl-2-prop-2-enylphenyl)ethanol
CID 158833372
4-(4-hydroxyphenyl)-2-prop-2-enylphenol
CID 70597664
1-ethyl-2,5-dimethyl-4-prop-2-enylbenzene
CID 147152105

Frequently Asked Questions

What is the IUPAC name of 4-(4-hydroxy-2-methyl-5-prop-2-enylphenyl)-5-methyl-2-prop-2-enylphenol?
The IUPAC name of 4-(4-hydroxy-2-methyl-5-prop-2-enylphenyl)-5-methyl-2-prop-2-enylphenol (CID 54433702) is 4-(4-hydroxy-2-methyl-5-prop-2-enylphenyl)-5-methyl-2-prop-2-enylphenol.
What is the SMILES notation for 4-(4-hydroxy-2-methyl-5-prop-2-enylphenyl)-5-methyl-2-prop-2-enylphenol?
The canonical SMILES for 4-(4-hydroxy-2-methyl-5-prop-2-enylphenyl)-5-methyl-2-prop-2-enylphenol is C=CCc1cc(-c2cc(CC=C)c(O)cc2C)c(C)cc1O.
What is the InChIKey of 4-(4-hydroxy-2-methyl-5-prop-2-enylphenyl)-5-methyl-2-prop-2-enylphenol?
The InChIKey is WJGUYRGCRSAPRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22O2/c1-5-7-15-11-17(13(3)9-19(15)21)18-12-16(8-6-2)20(22)10-14(18)4/h5-6,9-12,21-22H,1-2,7-8H2,3-4H3.
What are the key properties of 4-(4-hydroxy-2-methyl-5-prop-2-enylphenyl)-5-methyl-2-prop-2-enylphenol?
4-(4-hydroxy-2-methyl-5-prop-2-enylphenyl)-5-methyl-2-prop-2-enylphenol has a molecular weight of 294.39 g/mol, XLogP of 4.84, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-hydroxy-2-methyl-5-prop-2-enylphenyl)-5-methyl-2-prop-2-enylphenol is sourced from PubChem (CID 54433702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).