2,4-difluoro-1-[(E)-3-(4-methylphenyl)prop-2-enyl]benzene

C16H14F2 — CID 24762267

IUPAC2,4-difluoro-1-[(E)-3-(4-methylphenyl)prop-2-enyl]benzene
SMILESCc1ccc(/C=C/Cc2ccc(F)cc2F)cc1
InChIInChI=1S/C16H14F2/c1-12-5-7-13(8-6-12)3-2-4-14-9-10-15(17)11-16(14)18/h2-3,5-11H,4H2,1H3/b3-2+
InChIKeyRWDVQJUDXSHPQE-NSCUHMNNSA-N
MW244.28 g/mol
LogP4.53
Rot. Bonds3

About 2,4-difluoro-1-[(E)-3-(4-methylphenyl)prop-2-enyl]benzene

2,4-difluoro-1-[(E)-3-(4-methylphenyl)prop-2-enyl]benzene (PubChem CID 24762267) has the molecular formula C16H14F2 and a molecular weight of 244.28 g/mol. Its IUPAC name is 2,4-difluoro-1-[(E)-3-(4-methylphenyl)prop-2-enyl]benzene.

Molecular Properties

Compound Name2,4-difluoro-1-[(E)-3-(4-methylphenyl)prop-2-enyl]benzene
PubChem CID24762267
Molecular FormulaC16H14F2
Molecular Weight244.28 g/mol
Exact Mass244.11
IUPAC Name2,4-difluoro-1-[(E)-3-(4-methylphenyl)prop-2-enyl]benzene
SMILESCc1ccc(/C=C/Cc2ccc(F)cc2F)cc1
InChIInChI=1S/C16H14F2/c1-12-5-7-13(8-6-12)3-2-4-14-9-10-15(17)11-16(14)18/h2-3,5-11H,4H2,1H3/b3-2+
InChIKeyRWDVQJUDXSHPQE-NSCUHMNNSA-N
XLogP4.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.28
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-[(E)-3-(4-chlorophenyl)prop-2-enyl]-2,4-difluorobenzene
CID 24762264
1-[(E)-3-(4-bromophenyl)prop-2-enyl]-2,4-difluorobenzene
CID 24762261
2,4-dichloro-1-[(E)-3-(4-fluorophenyl)prop-2-enyl]benzene
CID 173119979
1-ethyl-4-[3-(4-methylphenyl)prop-1-enyl]benzene
CID 57014640
1-methyl-4-[4-[3-[4-[4-(4-methylphenyl)phenyl]phenyl]prop-2-enyl]phenyl]benzene
CID 161223242
1-chloro-4-[(E)-3-(4-methylphenyl)prop-1-enyl]benzene
CID 25149973
1-chloro-4-[(E)-3-(4-methylphenyl)prop-2-enyl]benzene
CID 11379525
(E)-1-(2,4-difluorophenyl)-3-(4-methylphenyl)prop-2-en-1-one
CID 8826849
1-[(E)-3-(4-methylphenyl)prop-2-enyl]naphthalene
CID 142146166
1,4-dimethyl-2-[(E)-3-phenylprop-2-enyl]benzene
CID 11746215
1-methyl-4-[4-[(E)-3-phenylprop-1-enyl]phenyl]benzene
CID 144681083
2-[(2,4-difluorophenyl)methylamino]-5-methylbenzenecarbothioamide
CID 107928886

Frequently Asked Questions

What is the IUPAC name of 2,4-difluoro-1-[(E)-3-(4-methylphenyl)prop-2-enyl]benzene?
The IUPAC name of 2,4-difluoro-1-[(E)-3-(4-methylphenyl)prop-2-enyl]benzene (CID 24762267) is 2,4-difluoro-1-[(E)-3-(4-methylphenyl)prop-2-enyl]benzene.
What is the SMILES notation for 2,4-difluoro-1-[(E)-3-(4-methylphenyl)prop-2-enyl]benzene?
The canonical SMILES for 2,4-difluoro-1-[(E)-3-(4-methylphenyl)prop-2-enyl]benzene is Cc1ccc(/C=C/Cc2ccc(F)cc2F)cc1.
What is the InChIKey of 2,4-difluoro-1-[(E)-3-(4-methylphenyl)prop-2-enyl]benzene?
The InChIKey is RWDVQJUDXSHPQE-NSCUHMNNSA-N. The full InChI is InChI=1S/C16H14F2/c1-12-5-7-13(8-6-12)3-2-4-14-9-10-15(17)11-16(14)18/h2-3,5-11H,4H2,1H3/b3-2+.
What are the key properties of 2,4-difluoro-1-[(E)-3-(4-methylphenyl)prop-2-enyl]benzene?
2,4-difluoro-1-[(E)-3-(4-methylphenyl)prop-2-enyl]benzene has a molecular weight of 244.28 g/mol, XLogP of 4.53, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-difluoro-1-[(E)-3-(4-methylphenyl)prop-2-enyl]benzene is sourced from PubChem (CID 24762267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).