1-fluoro-4-methoxy-2-[4-[(E)-prop-1-enyl]phenyl]benzene

C16H15FO — CID 145014279

IUPAC1-fluoro-4-methoxy-2-[4-[(E)-prop-1-enyl]phenyl]benzene
SMILESC/C=C/c1ccc(-c2cc(OC)ccc2F)cc1
InChIInChI=1S/C16H15FO/c1-3-4-12-5-7-13(8-6-12)15-11-14(18-2)9-10-16(15)17/h3-11H,1-2H3/b4-3+
InChIKeyUYAURZNMLJTNAO-ONEGZZNKSA-N
MW242.29 g/mol
LogP4.53
Rot. Bonds3

About 1-fluoro-4-methoxy-2-[4-[(E)-prop-1-enyl]phenyl]benzene

1-fluoro-4-methoxy-2-[4-[(E)-prop-1-enyl]phenyl]benzene (PubChem CID 145014279) has the molecular formula C16H15FO and a molecular weight of 242.29 g/mol. Its IUPAC name is 1-fluoro-4-methoxy-2-[4-[(E)-prop-1-enyl]phenyl]benzene.

Molecular Properties

Compound Name1-fluoro-4-methoxy-2-[4-[(E)-prop-1-enyl]phenyl]benzene
PubChem CID145014279
Molecular FormulaC16H15FO
Molecular Weight242.29 g/mol
Exact Mass242.11
IUPAC Name1-fluoro-4-methoxy-2-[4-[(E)-prop-1-enyl]phenyl]benzene
SMILESC/C=C/c1ccc(-c2cc(OC)ccc2F)cc1
InChIInChI=1S/C16H15FO/c1-3-4-12-5-7-13(8-6-12)15-11-14(18-2)9-10-16(15)17/h3-11H,1-2H3/b4-3+
InChIKeyUYAURZNMLJTNAO-ONEGZZNKSA-N
XLogP4.53
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.29
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-fluoro-3-(4-methoxyphenyl)benzaldehyde
CID 39231865
1-methoxy-4-prop-1-enylbenzene
CID 67322568
1-fluoro-4-methoxy-2-[4-[(E)-prop-1-enyl]cyclohexa-1,3-dien-1-yl]benzene
CID 144688837
2-(4-fluorophenyl)-1-methoxy-4-prop-1-enylbenzene
CID 141071420
4-(2-fluoro-5-methoxyphenyl)-2,6-dimethylbenzaldehyde
CID 172876954
4-fluoro-3-(6-methoxynaphthalen-2-yl)aniline
CID 104781273
5-(2-fluoro-5-methoxyphenyl)-2-hydroxybenzaldehyde
CID 53220437
ethane;1-fluoro-4-methoxy-2-[4-[(E)-prop-1-enyl]phenyl]benzene;methyl 3-[3-(acetyloxymethyl)-4-hydroxyphenyl]-3-cyclopropylpropanoate
CID 145014278
1-methoxy-4-[2-[4-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]phenyl]ethenyl]benzene
CID 54482883
2-(4-chlorophenyl)-4-methoxyphenol
CID 57199343
2-fluoro-1-methoxy-4-[(Z)-prop-1-enyl]benzene
CID 89214700
2-fluoro-1-(4-fluorophenyl)-4-methoxybenzene
CID 46312221

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-4-methoxy-2-[4-[(E)-prop-1-enyl]phenyl]benzene?
The IUPAC name of 1-fluoro-4-methoxy-2-[4-[(E)-prop-1-enyl]phenyl]benzene (CID 145014279) is 1-fluoro-4-methoxy-2-[4-[(E)-prop-1-enyl]phenyl]benzene.
What is the SMILES notation for 1-fluoro-4-methoxy-2-[4-[(E)-prop-1-enyl]phenyl]benzene?
The canonical SMILES for 1-fluoro-4-methoxy-2-[4-[(E)-prop-1-enyl]phenyl]benzene is C/C=C/c1ccc(-c2cc(OC)ccc2F)cc1.
What is the InChIKey of 1-fluoro-4-methoxy-2-[4-[(E)-prop-1-enyl]phenyl]benzene?
The InChIKey is UYAURZNMLJTNAO-ONEGZZNKSA-N. The full InChI is InChI=1S/C16H15FO/c1-3-4-12-5-7-13(8-6-12)15-11-14(18-2)9-10-16(15)17/h3-11H,1-2H3/b4-3+.
What are the key properties of 1-fluoro-4-methoxy-2-[4-[(E)-prop-1-enyl]phenyl]benzene?
1-fluoro-4-methoxy-2-[4-[(E)-prop-1-enyl]phenyl]benzene has a molecular weight of 242.29 g/mol, XLogP of 4.53, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-4-methoxy-2-[4-[(E)-prop-1-enyl]phenyl]benzene is sourced from PubChem (CID 145014279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).