(Z)-4-phenylbut-3-enal

C10H10O — CID 14006748

IUPAC(Z)-4-phenylbut-3-enal
SMILESO=CC/C=C\c1ccccc1
InChIInChI=1S/C10H10O/c11-9-5-4-8-10-6-2-1-3-7-10/h1-4,6-9H,5H2/b8-4-
InChIKeyZHOXGILWMHZMGW-YWEYNIOJSA-N
MW146.19 g/mol
LogP2.29
Rot. Bonds3

About (Z)-4-phenylbut-3-enal

(Z)-4-phenylbut-3-enal (PubChem CID 14006748) has the molecular formula C10H10O and a molecular weight of 146.19 g/mol. Its IUPAC name is (Z)-4-phenylbut-3-enal.

Molecular Properties

Compound Name(Z)-4-phenylbut-3-enal
PubChem CID14006748
Molecular FormulaC10H10O
Molecular Weight146.19 g/mol
Exact Mass146.07
IUPAC Name(Z)-4-phenylbut-3-enal
SMILESO=CC/C=C\c1ccccc1
InChIInChI=1S/C10H10O/c11-9-5-4-8-10-6-2-1-3-7-10/h1-4,6-9H,5H2/b8-4-
InChIKeyZHOXGILWMHZMGW-YWEYNIOJSA-N
XLogP2.29
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (Z)-4-phenylbut-3-enal with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (Z)-4-phenylbut-3-enal?
The IUPAC name of (Z)-4-phenylbut-3-enal (CID 14006748) is (Z)-4-phenylbut-3-enal.
What is the SMILES notation for (Z)-4-phenylbut-3-enal?
The canonical SMILES for (Z)-4-phenylbut-3-enal is O=CC/C=C\c1ccccc1.
What is the InChIKey of (Z)-4-phenylbut-3-enal?
The InChIKey is ZHOXGILWMHZMGW-YWEYNIOJSA-N. The full InChI is InChI=1S/C10H10O/c11-9-5-4-8-10-6-2-1-3-7-10/h1-4,6-9H,5H2/b8-4-.
What are the key properties of (Z)-4-phenylbut-3-enal?
(Z)-4-phenylbut-3-enal has a molecular weight of 146.19 g/mol, XLogP of 2.29, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4-phenylbut-3-enal is sourced from PubChem (CID 14006748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).