4-methyl-1-(4-methylphenyl)penta-2,3-dien-1-ol

C13H16O — CID 130125593

IUPAC4-methyl-1-(4-methylphenyl)penta-2,3-dien-1-ol
SMILESCC(C)=C=CC(O)c1ccc(C)cc1
InChIInChI=1S/C13H16O/c1-10(2)4-9-13(14)12-7-5-11(3)6-8-12/h5-9,13-14H,1-3H3
InChIKeyAEAVGEMAABDCEH-UHFFFAOYSA-N
MW188.27 g/mol
LogP3.15
Rot. Bonds2

About 4-methyl-1-(4-methylphenyl)penta-2,3-dien-1-ol

4-methyl-1-(4-methylphenyl)penta-2,3-dien-1-ol (PubChem CID 130125593) has the molecular formula C13H16O and a molecular weight of 188.27 g/mol. Its IUPAC name is 4-methyl-1-(4-methylphenyl)penta-2,3-dien-1-ol.

Molecular Properties

Compound Name4-methyl-1-(4-methylphenyl)penta-2,3-dien-1-ol
PubChem CID130125593
Molecular FormulaC13H16O
Molecular Weight188.27 g/mol
Exact Mass188.12
IUPAC Name4-methyl-1-(4-methylphenyl)penta-2,3-dien-1-ol
SMILESCC(C)=C=CC(O)c1ccc(C)cc1
InChIInChI=1S/C13H16O/c1-10(2)4-9-13(14)12-7-5-11(3)6-8-12/h5-9,13-14H,1-3H3
InChIKeyAEAVGEMAABDCEH-UHFFFAOYSA-N
XLogP3.15
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-tert-butylphenyl)-4-methylpenta-2,3-dien-1-ol
CID 21427339
(2S)-2-hydroxy-2-(4-methylphenyl)acetaldehyde
CID 130026128
1-(4-methylphenyl)prop-2-en-1-ol
CID 10931590
(E)-1-(4-methylphenyl)but-2-en-1-ol
CID 10866652
(E)-1-(4-methylphenyl)but-2-ene-1,4-diol
CID 70488994
(E,1S)-4,4-dimethyl-1-(4-methylphenyl)pent-2-en-1-ol;ethane;zinc
CID 11289501
(4-methylphenyl)-[4-(4-methylphenyl)phenyl]methanol
CID 143325793
amino-(4-methylphenyl)methanol
CID 70304176
(1R,5S)-1,3,5-tris(4-methylphenyl)pentane-1,5-diol
CID 139087432
1-methyl-4-[(E)-3-methylpent-3-en-2-yl]benzene
CID 166116462
2,2-bis(4-methylphenyl)acetaldehyde
CID 10867935
(E)-2-methyl-4-(4-methylphenyl)pent-2-en-1-ol
CID 90431836

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(4-methylphenyl)penta-2,3-dien-1-ol?
The IUPAC name of 4-methyl-1-(4-methylphenyl)penta-2,3-dien-1-ol (CID 130125593) is 4-methyl-1-(4-methylphenyl)penta-2,3-dien-1-ol.
What is the SMILES notation for 4-methyl-1-(4-methylphenyl)penta-2,3-dien-1-ol?
The canonical SMILES for 4-methyl-1-(4-methylphenyl)penta-2,3-dien-1-ol is CC(C)=C=CC(O)c1ccc(C)cc1.
What is the InChIKey of 4-methyl-1-(4-methylphenyl)penta-2,3-dien-1-ol?
The InChIKey is AEAVGEMAABDCEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16O/c1-10(2)4-9-13(14)12-7-5-11(3)6-8-12/h5-9,13-14H,1-3H3.
What are the key properties of 4-methyl-1-(4-methylphenyl)penta-2,3-dien-1-ol?
4-methyl-1-(4-methylphenyl)penta-2,3-dien-1-ol has a molecular weight of 188.27 g/mol, XLogP of 3.15, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(4-methylphenyl)penta-2,3-dien-1-ol is sourced from PubChem (CID 130125593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).