1-[(E)-3-methoxyprop-1-enyl]-2-phenylmethoxybenzene

C17H18O2 — CID 141153836

IUPAC1-[(E)-3-methoxyprop-1-enyl]-2-phenylmethoxybenzene
SMILESCOC/C=C/c1ccccc1OCc1ccccc1
InChIInChI=1S/C17H18O2/c1-18-13-7-11-16-10-5-6-12-17(16)19-14-15-8-3-2-4-9-15/h2-12H,13-14H2,1H3/b11-7+
InChIKeyQIKCKZKFOLTSFM-YRNVUSSQSA-N
MW254.33 g/mol
LogP3.93
Rot. Bonds6

About 1-[(E)-3-methoxyprop-1-enyl]-2-phenylmethoxybenzene

1-[(E)-3-methoxyprop-1-enyl]-2-phenylmethoxybenzene (PubChem CID 141153836) has the molecular formula C17H18O2 and a molecular weight of 254.33 g/mol. Its IUPAC name is 1-[(E)-3-methoxyprop-1-enyl]-2-phenylmethoxybenzene.

Molecular Properties

Compound Name1-[(E)-3-methoxyprop-1-enyl]-2-phenylmethoxybenzene
PubChem CID141153836
Molecular FormulaC17H18O2
Molecular Weight254.33 g/mol
Exact Mass254.13
IUPAC Name1-[(E)-3-methoxyprop-1-enyl]-2-phenylmethoxybenzene
SMILESCOC/C=C/c1ccccc1OCc1ccccc1
InChIInChI=1S/C17H18O2/c1-18-13-7-11-16-10-5-6-12-17(16)19-14-15-8-3-2-4-9-15/h2-12H,13-14H2,1H3/b11-7+
InChIKeyQIKCKZKFOLTSFM-YRNVUSSQSA-N
XLogP3.93
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-phenylmethoxyphenyl)but-3-en-1-ol
CID 54307612
1-(3-azidoprop-1-enyl)-2-phenylmethoxybenzene
CID 151010304
1-(methoxymethoxy)-3-[4-(2-phenylmethoxyphenyl)buta-1,3-dienyl]benzene
CID 54436415
1-methoxy-2-[(E)-3-phenoxyprop-1-enyl]benzene
CID 67215541
(E)-3-[2-[(E)-2-(2-phenylmethoxyphenyl)ethenyl]phenyl]prop-2-enoic acid
CID 11210487
(E)-N,N-dimethyl-3-(2-phenylmethoxyphenyl)prop-2-enamide
CID 15255199
N-tert-butyl-1-(2-phenylmethoxyphenyl)methanimine oxide
CID 86587910
methyl 3-methoxy-4-[2-(2-phenylmethoxyphenyl)ethenyl]benzoate
CID 70346485
(2-phenylmethoxyphenyl)methylidenehydrazine
CID 78678885
1-[(Z)-2-[2,4-bis(phenylmethoxy)phenyl]ethenyl]-2-(methoxymethoxy)-4-phenylmethoxybenzene
CID 52916293
2-[4-[[2-[(E)-prop-1-enyl]phenoxy]methyl]phenyl]ethanamine
CID 105348895
1-ethenyl-2-methoxy-3-phenylmethoxybenzene
CID 23251754

Frequently Asked Questions

What is the IUPAC name of 1-[(E)-3-methoxyprop-1-enyl]-2-phenylmethoxybenzene?
The IUPAC name of 1-[(E)-3-methoxyprop-1-enyl]-2-phenylmethoxybenzene (CID 141153836) is 1-[(E)-3-methoxyprop-1-enyl]-2-phenylmethoxybenzene.
What is the SMILES notation for 1-[(E)-3-methoxyprop-1-enyl]-2-phenylmethoxybenzene?
The canonical SMILES for 1-[(E)-3-methoxyprop-1-enyl]-2-phenylmethoxybenzene is COC/C=C/c1ccccc1OCc1ccccc1.
What is the InChIKey of 1-[(E)-3-methoxyprop-1-enyl]-2-phenylmethoxybenzene?
The InChIKey is QIKCKZKFOLTSFM-YRNVUSSQSA-N. The full InChI is InChI=1S/C17H18O2/c1-18-13-7-11-16-10-5-6-12-17(16)19-14-15-8-3-2-4-9-15/h2-12H,13-14H2,1H3/b11-7+.
What are the key properties of 1-[(E)-3-methoxyprop-1-enyl]-2-phenylmethoxybenzene?
1-[(E)-3-methoxyprop-1-enyl]-2-phenylmethoxybenzene has a molecular weight of 254.33 g/mol, XLogP of 3.93, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(E)-3-methoxyprop-1-enyl]-2-phenylmethoxybenzene is sourced from PubChem (CID 141153836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).