[(E)-1-methoxy-3-phenylprop-2-enyl]benzene

C16H16O — CID 10353588

IUPAC[(E)-1-methoxy-3-phenylprop-2-enyl]benzene
SMILESCOC(/C=C/c1ccccc1)c1ccccc1
InChIInChI=1S/C16H16O/c1-17-16(15-10-6-3-7-11-15)13-12-14-8-4-2-5-9-14/h2-13,16H,1H3/b13-12+
InChIKeyUWPBYZGUTOOHGA-OUKQBFOZSA-N
MW224.30 g/mol
LogP4.09
Rot. Bonds4

About [(E)-1-methoxy-3-phenylprop-2-enyl]benzene

[(E)-1-methoxy-3-phenylprop-2-enyl]benzene (PubChem CID 10353588) has the molecular formula C16H16O and a molecular weight of 224.30 g/mol. Its IUPAC name is [(E)-1-methoxy-3-phenylprop-2-enyl]benzene.

Molecular Properties

Compound Name[(E)-1-methoxy-3-phenylprop-2-enyl]benzene
PubChem CID10353588
Molecular FormulaC16H16O
Molecular Weight224.30 g/mol
Exact Mass224.12
IUPAC Name[(E)-1-methoxy-3-phenylprop-2-enyl]benzene
SMILESCOC(/C=C/c1ccccc1)c1ccccc1
InChIInChI=1S/C16H16O/c1-17-16(15-10-6-3-7-11-15)13-12-14-8-4-2-5-9-14/h2-13,16H,1H3/b13-12+
InChIKeyUWPBYZGUTOOHGA-OUKQBFOZSA-N
XLogP4.09
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

[(E,1R)-1-ethoxy-3-phenylprop-2-enyl]benzene
CID 100939369
[(E,1S)-1-methoxybut-2-enyl]benzene
CID 129385395
[(E)-1,3-diphenylprop-2-enoxy]benzene
CID 11289166
[(Z,3S,4R)-4-methoxy-3-methylpent-1-enyl]benzene
CID 102252703
[(2E,4E)-1-methoxyhexa-2,4-dienyl]benzene
CID 164672506
tert-butyl-[(E)-1,3-diphenylprop-2-enoxy]-diphenylsilane
CID 135009658
(3-bromo-3-methoxyprop-1-enyl)benzene
CID 118936577
[(E)-1,3-diphenylprop-2-enyl] dihydrogen phosphate
CID 175349156
1-methoxyprop-2-enylbenzene
CID 11029990
tert-butyl-[(E,1S)-4-methoxy-1,4-diphenylbut-2-enoxy]-dimethylsilane
CID 101242327
(E)-N-[(E)-1,3-diphenylprop-2-enoxy]-1-(4-methylphenyl)methanimine
CID 45378867
N-[(E)-1,3-diphenylprop-2-enoxy]-1,1-diphenylmethanimine
CID 45378873

Frequently Asked Questions

What is the IUPAC name of [(E)-1-methoxy-3-phenylprop-2-enyl]benzene?
The IUPAC name of [(E)-1-methoxy-3-phenylprop-2-enyl]benzene (CID 10353588) is [(E)-1-methoxy-3-phenylprop-2-enyl]benzene.
What is the SMILES notation for [(E)-1-methoxy-3-phenylprop-2-enyl]benzene?
The canonical SMILES for [(E)-1-methoxy-3-phenylprop-2-enyl]benzene is COC(/C=C/c1ccccc1)c1ccccc1.
What is the InChIKey of [(E)-1-methoxy-3-phenylprop-2-enyl]benzene?
The InChIKey is UWPBYZGUTOOHGA-OUKQBFOZSA-N. The full InChI is InChI=1S/C16H16O/c1-17-16(15-10-6-3-7-11-15)13-12-14-8-4-2-5-9-14/h2-13,16H,1H3/b13-12+.
What are the key properties of [(E)-1-methoxy-3-phenylprop-2-enyl]benzene?
[(E)-1-methoxy-3-phenylprop-2-enyl]benzene has a molecular weight of 224.30 g/mol, XLogP of 4.09, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-1-methoxy-3-phenylprop-2-enyl]benzene is sourced from PubChem (CID 10353588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).