[(Z)-4-methoxybut-3-en-2-yl]benzene

C11H14O — CID 10558945

IUPAC[(Z)-4-methoxybut-3-en-2-yl]benzene
SMILESCO/C=C\C(C)c1ccccc1
InChIInChI=1S/C11H14O/c1-10(8-9-12-2)11-6-4-3-5-7-11/h3-10H,1-2H3/b9-8-
InChIKeyHFVNPIZPUZCSOB-HJWRWDBZSA-N
MW162.23 g/mol
LogP2.95
Rot. Bonds3

About [(Z)-4-methoxybut-3-en-2-yl]benzene

[(Z)-4-methoxybut-3-en-2-yl]benzene (PubChem CID 10558945) has the molecular formula C11H14O and a molecular weight of 162.23 g/mol. Its IUPAC name is [(Z)-4-methoxybut-3-en-2-yl]benzene.

Molecular Properties

Compound Name[(Z)-4-methoxybut-3-en-2-yl]benzene
PubChem CID10558945
Molecular FormulaC11H14O
Molecular Weight162.23 g/mol
Exact Mass162.10
IUPAC Name[(Z)-4-methoxybut-3-en-2-yl]benzene
SMILESCO/C=C\C(C)c1ccccc1
InChIInChI=1S/C11H14O/c1-10(8-9-12-2)11-6-4-3-5-7-11/h3-10H,1-2H3/b9-8-
InChIKeyHFVNPIZPUZCSOB-HJWRWDBZSA-N
XLogP2.95
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.23
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze [(Z)-4-methoxybut-3-en-2-yl]benzene with MolForge

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

Launch Full Analysis

Related Compounds

3-phenylbut-1-enyl acetate
CID 154165575
(2R,3R)-3-[(E,3S)-3-phenylbut-1-enoxy]butan-2-ol
CID 135045876
[(Z)-pent-3-en-2-yl]benzene
CID 12697650
(E)-3-phenylbut-1-en-1-amine
CID 22024726
[(E)-5,5-di(propan-2-yloxy)pent-3-en-2-yl]benzene
CID 21423450
4-methoxybut-3-en-2-ylsulfanylbenzene
CID 131869014
(Z)-4-phenylpent-2-en-1-ol
CID 10725679
5-chloropent-3-en-2-ylbenzene
CID 71345200
2-phenylpropaneselenal
CID 141365712
1,1-dimethoxyethane;2-phenylpropanal
CID 87274023
4-phenylpent-2-enylbenzene
CID 72731182
trimethyl-[(E)-4-phenylpent-2-enyl]silane
CID 10889393

Frequently Asked Questions

What is the IUPAC name of [(Z)-4-methoxybut-3-en-2-yl]benzene?
The IUPAC name of [(Z)-4-methoxybut-3-en-2-yl]benzene (CID 10558945) is [(Z)-4-methoxybut-3-en-2-yl]benzene.
What is the SMILES notation for [(Z)-4-methoxybut-3-en-2-yl]benzene?
The canonical SMILES for [(Z)-4-methoxybut-3-en-2-yl]benzene is CO/C=C\C(C)c1ccccc1.
What is the InChIKey of [(Z)-4-methoxybut-3-en-2-yl]benzene?
The InChIKey is HFVNPIZPUZCSOB-HJWRWDBZSA-N. The full InChI is InChI=1S/C11H14O/c1-10(8-9-12-2)11-6-4-3-5-7-11/h3-10H,1-2H3/b9-8-.
What are the key properties of [(Z)-4-methoxybut-3-en-2-yl]benzene?
[(Z)-4-methoxybut-3-en-2-yl]benzene has a molecular weight of 162.23 g/mol, XLogP of 2.95, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-4-methoxybut-3-en-2-yl]benzene is sourced from PubChem (CID 10558945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).