1-ethenyl-2,3-difluoro-4-phenylmethoxybenzene

C15H12F2O — CID 172563052

IUPAC1-ethenyl-2,3-difluoro-4-phenylmethoxybenzene
SMILESC=Cc1ccc(OCc2ccccc2)c(F)c1F
InChIInChI=1S/C15H12F2O/c1-2-12-8-9-13(15(17)14(12)16)18-10-11-6-4-3-5-7-11/h2-9H,1,10H2
InChIKeyLMEDGLFPNJZINB-UHFFFAOYSA-N
MW246.26 g/mol
LogP4.19
Rot. Bonds4

About 1-ethenyl-2,3-difluoro-4-phenylmethoxybenzene

1-ethenyl-2,3-difluoro-4-phenylmethoxybenzene (PubChem CID 172563052) has the molecular formula C15H12F2O and a molecular weight of 246.26 g/mol. Its IUPAC name is 1-ethenyl-2,3-difluoro-4-phenylmethoxybenzene.

Molecular Properties

Compound Name1-ethenyl-2,3-difluoro-4-phenylmethoxybenzene
PubChem CID172563052
Molecular FormulaC15H12F2O
Molecular Weight246.26 g/mol
Exact Mass246.09
IUPAC Name1-ethenyl-2,3-difluoro-4-phenylmethoxybenzene
SMILESC=Cc1ccc(OCc2ccccc2)c(F)c1F
InChIInChI=1S/C15H12F2O/c1-2-12-8-9-13(15(17)14(12)16)18-10-11-6-4-3-5-7-11/h2-9H,1,10H2
InChIKeyLMEDGLFPNJZINB-UHFFFAOYSA-N
XLogP4.19
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.26
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2,3-difluoro-1-methyl-4-phenylmethoxybenzene
CID 57470603
2-ethenyl-3-phenylmethoxynaphthalene
CID 102243769
2-[4-[4-[(4-ethenyl-2,3-difluorophenoxy)methyl]phenyl]-2-fluorophenyl]oxirane
CID 88977792
1-ethenyl-2-methoxy-3-phenylmethoxybenzene
CID 23251754
2,3-difluoro-4-phenylmethoxybenzenesulfonyl chloride
CID 63036759
1-ethenyl-2-methyl-3,5-bis(phenylmethoxy)benzene
CID 123206589
2-(2,6-difluoro-3-phenylmethoxyphenyl)pyridine
CID 174635964
1-(4-bromophenyl)-2,3-difluoro-4-phenylmethoxybenzene
CID 54164319
1,3-difluoro-2-methylsulfanyl-4-phenylmethoxybenzene
CID 164892505
(3-fluoro-2-iodo-4-phenylmethoxyphenyl)methanol
CID 137378511
4-ethenyl-1-phenylmethoxy-2-(trifluoromethoxy)benzene
CID 155293536
4,5-difluoro-2-phenylmethoxybenzaldehyde
CID 129164784

Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-2,3-difluoro-4-phenylmethoxybenzene?
The IUPAC name of 1-ethenyl-2,3-difluoro-4-phenylmethoxybenzene (CID 172563052) is 1-ethenyl-2,3-difluoro-4-phenylmethoxybenzene.
What is the SMILES notation for 1-ethenyl-2,3-difluoro-4-phenylmethoxybenzene?
The canonical SMILES for 1-ethenyl-2,3-difluoro-4-phenylmethoxybenzene is C=Cc1ccc(OCc2ccccc2)c(F)c1F.
What is the InChIKey of 1-ethenyl-2,3-difluoro-4-phenylmethoxybenzene?
The InChIKey is LMEDGLFPNJZINB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12F2O/c1-2-12-8-9-13(15(17)14(12)16)18-10-11-6-4-3-5-7-11/h2-9H,1,10H2.
What are the key properties of 1-ethenyl-2,3-difluoro-4-phenylmethoxybenzene?
1-ethenyl-2,3-difluoro-4-phenylmethoxybenzene has a molecular weight of 246.26 g/mol, XLogP of 4.19, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-2,3-difluoro-4-phenylmethoxybenzene is sourced from PubChem (CID 172563052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).