1-[(Z)-3-ethoxy-2-fluoroprop-1-enyl]-4-methoxybenzene

C12H15FO2 — CID 101020500

IUPAC1-[(Z)-3-ethoxy-2-fluoroprop-1-enyl]-4-methoxybenzene
SMILESCCOC/C(F)=C/c1ccc(OC)cc1
InChIInChI=1S/C12H15FO2/c1-3-15-9-11(13)8-10-4-6-12(14-2)7-5-10/h4-8H,3,9H2,1-2H3/b11-8-
InChIKeyDCXIMROKLZPVLR-FLIBITNWSA-N
MW210.25 g/mol
LogP3.04
Rot. Bonds5

About 1-[(Z)-3-ethoxy-2-fluoroprop-1-enyl]-4-methoxybenzene

1-[(Z)-3-ethoxy-2-fluoroprop-1-enyl]-4-methoxybenzene (PubChem CID 101020500) has the molecular formula C12H15FO2 and a molecular weight of 210.25 g/mol. Its IUPAC name is 1-[(Z)-3-ethoxy-2-fluoroprop-1-enyl]-4-methoxybenzene.

Molecular Properties

Compound Name1-[(Z)-3-ethoxy-2-fluoroprop-1-enyl]-4-methoxybenzene
PubChem CID101020500
Molecular FormulaC12H15FO2
Molecular Weight210.25 g/mol
Exact Mass210.11
IUPAC Name1-[(Z)-3-ethoxy-2-fluoroprop-1-enyl]-4-methoxybenzene
SMILESCCOC/C(F)=C/c1ccc(OC)cc1
InChIInChI=1S/C12H15FO2/c1-3-15-9-11(13)8-10-4-6-12(14-2)7-5-10/h4-8H,3,9H2,1-2H3/b11-8-
InChIKeyDCXIMROKLZPVLR-FLIBITNWSA-N
XLogP3.04
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.25
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-methoxy-4-[(Z)-2,4,4,4-tetrafluorobut-1-enyl]benzene
CID 177473841
[2-fluoro-3-(4-methoxyphenyl)prop-2-enyl] 2-methylprop-2-enoate
CID 139950838
1-[(E)-2-fluoroprop-1-enyl]-4-methoxybenzene
CID 125475931
1-(2,2-dibromoethenyl)-4-methoxybenzene
CID 10859278
(Z)-2-fluoro-3-(4-methoxyphenyl)prop-2-enal
CID 10965119
1-methoxy-4-[(Z)-1-(4-methoxyphenyl)but-1-en-2-yl]benzene
CID 22860829
(Z)-2-ethoxy-3-(4-methoxyphenyl)prop-2-enal
CID 46183091
N-[1,4-bis(4-methoxyphenyl)-3-(methylideneamino)buta-1,3-dien-2-yl]methanimine
CID 162990023
2-[(4-methoxyphenyl)methylidene]butan-1-amine
CID 79321876
methyl (Z)-2-ethoxy-3-(4-methoxyphenyl)prop-2-enoate
CID 70545359
1-(3-bromo-2-methylprop-1-enyl)-4-methoxybenzene
CID 79323342
1-(3-chloro-2-methylprop-1-enyl)-4-methoxybenzene
CID 70503857

Frequently Asked Questions

What is the IUPAC name of 1-[(Z)-3-ethoxy-2-fluoroprop-1-enyl]-4-methoxybenzene?
The IUPAC name of 1-[(Z)-3-ethoxy-2-fluoroprop-1-enyl]-4-methoxybenzene (CID 101020500) is 1-[(Z)-3-ethoxy-2-fluoroprop-1-enyl]-4-methoxybenzene.
What is the SMILES notation for 1-[(Z)-3-ethoxy-2-fluoroprop-1-enyl]-4-methoxybenzene?
The canonical SMILES for 1-[(Z)-3-ethoxy-2-fluoroprop-1-enyl]-4-methoxybenzene is CCOC/C(F)=C/c1ccc(OC)cc1.
What is the InChIKey of 1-[(Z)-3-ethoxy-2-fluoroprop-1-enyl]-4-methoxybenzene?
The InChIKey is DCXIMROKLZPVLR-FLIBITNWSA-N. The full InChI is InChI=1S/C12H15FO2/c1-3-15-9-11(13)8-10-4-6-12(14-2)7-5-10/h4-8H,3,9H2,1-2H3/b11-8-.
What are the key properties of 1-[(Z)-3-ethoxy-2-fluoroprop-1-enyl]-4-methoxybenzene?
1-[(Z)-3-ethoxy-2-fluoroprop-1-enyl]-4-methoxybenzene has a molecular weight of 210.25 g/mol, XLogP of 3.04, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(Z)-3-ethoxy-2-fluoroprop-1-enyl]-4-methoxybenzene is sourced from PubChem (CID 101020500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).