(3E)-2-phenylpenta-1,3-dien-3-ol

C11H12O — CID 126638860

IUPAC(3E)-2-phenylpenta-1,3-dien-3-ol
SMILESC=C(/C(O)=C\C)c1ccccc1
InChIInChI=1S/C11H12O/c1-3-11(12)9(2)10-7-5-4-6-8-10/h3-8,12H,2H2,1H3/b11-3+
InChIKeyUTVKQAYJAHBYHN-QDEBKDIKSA-N
MW160.22 g/mol
LogP3.16
Rot. Bonds2

About (3E)-2-phenylpenta-1,3-dien-3-ol

(3E)-2-phenylpenta-1,3-dien-3-ol (PubChem CID 126638860) has the molecular formula C11H12O and a molecular weight of 160.22 g/mol. Its IUPAC name is (3E)-2-phenylpenta-1,3-dien-3-ol.

Molecular Properties

Compound Name(3E)-2-phenylpenta-1,3-dien-3-ol
PubChem CID126638860
Molecular FormulaC11H12O
Molecular Weight160.22 g/mol
Exact Mass160.09
IUPAC Name(3E)-2-phenylpenta-1,3-dien-3-ol
SMILESC=C(/C(O)=C\C)c1ccccc1
InChIInChI=1S/C11H12O/c1-3-11(12)9(2)10-7-5-4-6-8-10/h3-8,12H,2H2,1H3/b11-3+
InChIKeyUTVKQAYJAHBYHN-QDEBKDIKSA-N
XLogP3.16
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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

3-phenylbuta-1,3-dien-2-ylbenzene;[(Z)-3-phenylbut-2-en-2-yl]benzene
CID 143250660
ethane;2-phenylprop-2-enoic acid
CID 142472843
[(2E,5Z)-4-methylidenehepta-2,5-dien-3-yl]benzene
CID 153494817
[(E)-but-2-en-2-yl]benzene;methane;2-methylprop-1-ene
CID 155717398
4-phenylhexa-2,4-dien-3-ylbenzene
CID 2802592
[(3Z)-2-iodopenta-1,3-dien-3-yl]benzene
CID 125477418
ethane;[(3Z)-penta-1,3-dien-2-yl]benzene
CID 142853648
CID 159091938
CID 159091938
2-phenylprop-2-enoic acid;prop-2-enoic acid
CID 70022748
acetaldehyde;buta-1,3-dien-2-ylbenzene
CID 23325207
ethane;tris(prop-1-en-2-ylbenzene)
CID 161299444
prop-1-en-2-ylbenzene;silane
CID 174724970

Frequently Asked Questions

What is the IUPAC name of (3E)-2-phenylpenta-1,3-dien-3-ol?
The IUPAC name of (3E)-2-phenylpenta-1,3-dien-3-ol (CID 126638860) is (3E)-2-phenylpenta-1,3-dien-3-ol.
What is the SMILES notation for (3E)-2-phenylpenta-1,3-dien-3-ol?
The canonical SMILES for (3E)-2-phenylpenta-1,3-dien-3-ol is C=C(/C(O)=C\C)c1ccccc1.
What is the InChIKey of (3E)-2-phenylpenta-1,3-dien-3-ol?
The InChIKey is UTVKQAYJAHBYHN-QDEBKDIKSA-N. The full InChI is InChI=1S/C11H12O/c1-3-11(12)9(2)10-7-5-4-6-8-10/h3-8,12H,2H2,1H3/b11-3+.
What are the key properties of (3E)-2-phenylpenta-1,3-dien-3-ol?
(3E)-2-phenylpenta-1,3-dien-3-ol has a molecular weight of 160.22 g/mol, XLogP of 3.16, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3E)-2-phenylpenta-1,3-dien-3-ol is sourced from PubChem (CID 126638860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).