1-methoxy-4-[(Z)-2,4,4,4-tetrafluorobut-1-enyl]benzene

C11H10F4O — CID 177473841

IUPAC1-methoxy-4-[(Z)-2,4,4,4-tetrafluorobut-1-enyl]benzene
SMILESCOc1ccc(/C=C(\F)CC(F)(F)F)cc1
InChIInChI=1S/C11H10F4O/c1-16-10-4-2-8(3-5-10)6-9(12)7-11(13,14)15/h2-6H,7H2,1H3/b9-6-
InChIKeyNFHNZRRUVYBBNX-TWGQIWQCSA-N
MW234.19 g/mol
LogP3.96
Rot. Bonds3

About 1-methoxy-4-[(Z)-2,4,4,4-tetrafluorobut-1-enyl]benzene

1-methoxy-4-[(Z)-2,4,4,4-tetrafluorobut-1-enyl]benzene (PubChem CID 177473841) has the molecular formula C11H10F4O and a molecular weight of 234.19 g/mol. Its IUPAC name is 1-methoxy-4-[(Z)-2,4,4,4-tetrafluorobut-1-enyl]benzene.

Molecular Properties

Compound Name1-methoxy-4-[(Z)-2,4,4,4-tetrafluorobut-1-enyl]benzene
PubChem CID177473841
Molecular FormulaC11H10F4O
Molecular Weight234.19 g/mol
Exact Mass234.07
IUPAC Name1-methoxy-4-[(Z)-2,4,4,4-tetrafluorobut-1-enyl]benzene
SMILESCOc1ccc(/C=C(\F)CC(F)(F)F)cc1
InChIInChI=1S/C11H10F4O/c1-16-10-4-2-8(3-5-10)6-9(12)7-11(13,14)15/h2-6H,7H2,1H3/b9-6-
InChIKeyNFHNZRRUVYBBNX-TWGQIWQCSA-N
XLogP3.96
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.19
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-[(Z)-3-ethoxy-2-fluoroprop-1-enyl]-4-methoxybenzene
CID 101020500
1-[(E)-2-fluoroprop-1-enyl]-4-methoxybenzene
CID 125475931
(Z)-2-fluoro-3-(4-methoxyphenyl)prop-2-enal
CID 10965119
[2-fluoro-3-(4-methoxyphenyl)prop-2-enyl] 2-methylprop-2-enoate
CID 139950838
1-(2,2-dibromoethenyl)-4-methoxybenzene
CID 10859278
(3E)-1,1,1-trifluoro-3-[(4-methoxyphenyl)methylidene]hexan-2-ol
CID 10802265
N-[1,4-bis(4-methoxyphenyl)-3-(methylideneamino)buta-1,3-dien-2-yl]methanimine
CID 162990023
1-(3-chloro-2-methylprop-1-enyl)-4-methoxybenzene
CID 70503857
1-(3-bromo-2-methylprop-1-enyl)-4-methoxybenzene
CID 79323342
1-methoxy-4-[(Z)-1-(4-methoxyphenyl)but-1-en-2-yl]benzene
CID 22860829
(2E,3E)-2,3-bis[(4-methoxyphenyl)methylidene]butanedial
CID 12694230
methyl (Z)-3-(4-methoxyphenyl)-2-(trifluoromethylsulfanylmethyl)prop-2-enoate
CID 138974440

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-4-[(Z)-2,4,4,4-tetrafluorobut-1-enyl]benzene?
The IUPAC name of 1-methoxy-4-[(Z)-2,4,4,4-tetrafluorobut-1-enyl]benzene (CID 177473841) is 1-methoxy-4-[(Z)-2,4,4,4-tetrafluorobut-1-enyl]benzene.
What is the SMILES notation for 1-methoxy-4-[(Z)-2,4,4,4-tetrafluorobut-1-enyl]benzene?
The canonical SMILES for 1-methoxy-4-[(Z)-2,4,4,4-tetrafluorobut-1-enyl]benzene is COc1ccc(/C=C(\F)CC(F)(F)F)cc1.
What is the InChIKey of 1-methoxy-4-[(Z)-2,4,4,4-tetrafluorobut-1-enyl]benzene?
The InChIKey is NFHNZRRUVYBBNX-TWGQIWQCSA-N. The full InChI is InChI=1S/C11H10F4O/c1-16-10-4-2-8(3-5-10)6-9(12)7-11(13,14)15/h2-6H,7H2,1H3/b9-6-.
What are the key properties of 1-methoxy-4-[(Z)-2,4,4,4-tetrafluorobut-1-enyl]benzene?
1-methoxy-4-[(Z)-2,4,4,4-tetrafluorobut-1-enyl]benzene has a molecular weight of 234.19 g/mol, XLogP of 3.96, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-4-[(Z)-2,4,4,4-tetrafluorobut-1-enyl]benzene is sourced from PubChem (CID 177473841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).