1-(2,2-difluoro-1-phenylethenyl)-4-methylbenzene

C15H12F2 — CID 101461718

IUPAC1-(2,2-difluoro-1-phenylethenyl)-4-methylbenzene
SMILESCc1ccc(C(=C(F)F)c2ccccc2)cc1
InChIInChI=1S/C15H12F2/c1-11-7-9-13(10-8-11)14(15(16)17)12-5-3-2-4-6-12/h2-10H,1H3
InChIKeyFMDRRGCXMSFFSY-UHFFFAOYSA-N
MW230.26 g/mol
LogP4.65
Rot. Bonds2

About 1-(2,2-difluoro-1-phenylethenyl)-4-methylbenzene

1-(2,2-difluoro-1-phenylethenyl)-4-methylbenzene (PubChem CID 101461718) has the molecular formula C15H12F2 and a molecular weight of 230.26 g/mol. Its IUPAC name is 1-(2,2-difluoro-1-phenylethenyl)-4-methylbenzene.

Molecular Properties

Compound Name1-(2,2-difluoro-1-phenylethenyl)-4-methylbenzene
PubChem CID101461718
Molecular FormulaC15H12F2
Molecular Weight230.26 g/mol
Exact Mass230.09
IUPAC Name1-(2,2-difluoro-1-phenylethenyl)-4-methylbenzene
SMILESCc1ccc(C(=C(F)F)c2ccccc2)cc1
InChIInChI=1S/C15H12F2/c1-11-7-9-13(10-8-11)14(15(16)17)12-5-3-2-4-6-12/h2-10H,1H3
InChIKeyFMDRRGCXMSFFSY-UHFFFAOYSA-N
XLogP4.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.26
LogP ≤ 54.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1-(2,2-difluoro-1-phenylethenyl)-4-methylbenzene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[2,2-difluoro-1-(4-methylphenyl)ethenyl]-4-phenylbenzene
CID 72708016
1,3,5-tris[4-[(E)-2-(4-methylphenyl)-1,2-diphenylethenyl]phenyl]benzene
CID 170669630
1-[(Z)-1-chloro-2-(4-methylphenyl)-2-phenylethenyl]-4-methylbenzene
CID 100919311
1-[2,2-bis(4-methylphenyl)-1-[4-[4-[(Z)-2-(4-methylphenyl)-1,2-diphenylethenyl]phenoxy]phenyl]ethenyl]-4-methylbenzene
CID 58942110
(NZ)-N-[(4-methylphenyl)-phenylmethylidene]hydroxylamine
CID 6303063
1-[(E)-1,2-dibromo-2-phenylethenyl]-4-methylbenzene
CID 101391865
benzoic acid;4-methylbenzoic acid
CID 71272637
diphenylmethanone;(4-methylphenyl)-phenylmethanone
CID 69336781
1-[(E)-1,2-diphenylbut-1-enyl]-4-methylbenzene;ethane
CID 143267176
(Z)-2,3-bis(4-methylphenyl)-3-phenylprop-2-enenitrile
CID 177384504
3-[2,2-difluoro-1-(4-methylphenyl)ethenyl]-1H-indole
CID 172643302
1-(4-methylphenyl)-3,3-diphenyl-2-(trifluoromethyl)prop-2-en-1-one
CID 71363336

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-difluoro-1-phenylethenyl)-4-methylbenzene?
The IUPAC name of 1-(2,2-difluoro-1-phenylethenyl)-4-methylbenzene (CID 101461718) is 1-(2,2-difluoro-1-phenylethenyl)-4-methylbenzene.
What is the SMILES notation for 1-(2,2-difluoro-1-phenylethenyl)-4-methylbenzene?
The canonical SMILES for 1-(2,2-difluoro-1-phenylethenyl)-4-methylbenzene is Cc1ccc(C(=C(F)F)c2ccccc2)cc1.
What is the InChIKey of 1-(2,2-difluoro-1-phenylethenyl)-4-methylbenzene?
The InChIKey is FMDRRGCXMSFFSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12F2/c1-11-7-9-13(10-8-11)14(15(16)17)12-5-3-2-4-6-12/h2-10H,1H3.
What are the key properties of 1-(2,2-difluoro-1-phenylethenyl)-4-methylbenzene?
1-(2,2-difluoro-1-phenylethenyl)-4-methylbenzene has a molecular weight of 230.26 g/mol, XLogP of 4.65, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-difluoro-1-phenylethenyl)-4-methylbenzene is sourced from PubChem (CID 101461718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).