4-[(1Z,3E)-3-hydroxypenta-1,3-dienyl]phenol

C11H12O2 — CID 144837467

IUPAC4-[(1Z,3E)-3-hydroxypenta-1,3-dienyl]phenol
SMILESC/C=C(O)\C=C/c1ccc(O)cc1
InChIInChI=1S/C11H12O2/c1-2-10(12)6-3-9-4-7-11(13)8-5-9/h2-8,12-13H,1H3/b6-3-,10-2+
InChIKeyFQFVPZRFEUHZSB-ZGRBTRKNSA-N
MW176.21 g/mol
LogP2.87
Rot. Bonds2

About 4-[(1Z,3E)-3-hydroxypenta-1,3-dienyl]phenol

4-[(1Z,3E)-3-hydroxypenta-1,3-dienyl]phenol (PubChem CID 144837467) has the molecular formula C11H12O2 and a molecular weight of 176.21 g/mol. Its IUPAC name is 4-[(1Z,3E)-3-hydroxypenta-1,3-dienyl]phenol.

Molecular Properties

Compound Name4-[(1Z,3E)-3-hydroxypenta-1,3-dienyl]phenol
PubChem CID144837467
Molecular FormulaC11H12O2
Molecular Weight176.21 g/mol
Exact Mass176.08
IUPAC Name4-[(1Z,3E)-3-hydroxypenta-1,3-dienyl]phenol
SMILESC/C=C(O)\C=C/c1ccc(O)cc1
InChIInChI=1S/C11H12O2/c1-2-10(12)6-3-9-4-7-11(13)8-5-9/h2-8,12-13H,1H3/b6-3-,10-2+
InChIKeyFQFVPZRFEUHZSB-ZGRBTRKNSA-N
XLogP2.87
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.21
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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CID 175665468
4-[(1E,3E,5Z)-4-hydroxyhepta-1,3,5-trienyl]phenol
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tris(3-(4-hydroxyphenyl)prop-2-enoic acid);lanthanum
CID 153328544
4-(4-hydroxyphenyl)but-3-en-2-one
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4-[(E)-2-[4-[(E)-2-phenylethenyl]phenyl]ethenyl]phenol
CID 52942315
4-(2-phenylethenyl)phenol
CID 157400568
3-[4-(4-hydroxyphenyl)phenyl]prop-2-enoic acid
CID 68584496
4-[(1E)-3-methoxybuta-1,3-dienyl]phenol
CID 144568960
3-(4-hydroxyphenyl)prop-2-enethioamide
CID 136649174
4-[6-(4-hydroxyphenyl)hexa-1,3,5-trienyl]phenol
CID 73020850
4-[18-(4-hydroxyphenyl)-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaenyl]phenol
CID 76584556

Frequently Asked Questions

What is the IUPAC name of 4-[(1Z,3E)-3-hydroxypenta-1,3-dienyl]phenol?
The IUPAC name of 4-[(1Z,3E)-3-hydroxypenta-1,3-dienyl]phenol (CID 144837467) is 4-[(1Z,3E)-3-hydroxypenta-1,3-dienyl]phenol.
What is the SMILES notation for 4-[(1Z,3E)-3-hydroxypenta-1,3-dienyl]phenol?
The canonical SMILES for 4-[(1Z,3E)-3-hydroxypenta-1,3-dienyl]phenol is C/C=C(O)\C=C/c1ccc(O)cc1.
What is the InChIKey of 4-[(1Z,3E)-3-hydroxypenta-1,3-dienyl]phenol?
The InChIKey is FQFVPZRFEUHZSB-ZGRBTRKNSA-N. The full InChI is InChI=1S/C11H12O2/c1-2-10(12)6-3-9-4-7-11(13)8-5-9/h2-8,12-13H,1H3/b6-3-,10-2+.
What are the key properties of 4-[(1Z,3E)-3-hydroxypenta-1,3-dienyl]phenol?
4-[(1Z,3E)-3-hydroxypenta-1,3-dienyl]phenol has a molecular weight of 176.21 g/mol, XLogP of 2.87, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1Z,3E)-3-hydroxypenta-1,3-dienyl]phenol is sourced from PubChem (CID 144837467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).