(3,3-difluoro-1-phenylbut-1-enyl)benzene

C16H14F2 — CID 174901374

IUPAC(3,3-difluoro-1-phenylbut-1-enyl)benzene
SMILESCC(F)(F)C=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H14F2/c1-16(17,18)12-15(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-12H,1H3
InChIKeyIVDQMJSTIDWSOX-UHFFFAOYSA-N
MW244.28 g/mol
LogP4.77
Rot. Bonds3

About (3,3-difluoro-1-phenylbut-1-enyl)benzene

(3,3-difluoro-1-phenylbut-1-enyl)benzene (PubChem CID 174901374) has the molecular formula C16H14F2 and a molecular weight of 244.28 g/mol. Its IUPAC name is (3,3-difluoro-1-phenylbut-1-enyl)benzene.

Molecular Properties

Compound Name(3,3-difluoro-1-phenylbut-1-enyl)benzene
PubChem CID174901374
Molecular FormulaC16H14F2
Molecular Weight244.28 g/mol
Exact Mass244.11
IUPAC Name(3,3-difluoro-1-phenylbut-1-enyl)benzene
SMILESCC(F)(F)C=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H14F2/c1-16(17,18)12-15(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-12H,1H3
InChIKeyIVDQMJSTIDWSOX-UHFFFAOYSA-N
XLogP4.77
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 ≤ 54.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze (3,3-difluoro-1-phenylbut-1-enyl)benzene 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

2-methyl-4,4-diphenylbut-3-en-2-amine
CID 11118093
(NE)-N-[2-(2,2-diphenylethenyl)-2-methyl-4,4-diphenylbut-3-enylidene]hydroxylamine
CID 11743387
1-[(Z)-4-bromo-3,3,4,4-tetrafluoro-1-phenylbut-1-enyl]-4-methylbenzene
CID 132943042
(8-chloro-3,3,4,4,5,5,6,6,7,7,8,8-dodecafluoro-1-phenyloct-1-enyl)benzene
CID 100930798
[1-phenyl-2-(trifluoromethylsulfanyl)ethenyl]benzene
CID 132521031
[(2,2-dimethyl-4,4-diphenylbut-3-enyl)-iodoboranyl]phosphane
CID 21027985
1,2,3-trimethoxy-5-[(E)-3,3,3-trifluoro-1-phenylprop-1-enyl]benzene
CID 132533219
bromo(trifluoro)methane;3,3-diphenylprop-2-enenitrile
CID 174367597
(E)-3,3-dimethyl-1-phenylbut-1-en-1-amine
CID 67619754
[(Z)-8-chloro-5,5,6,6,7,7,8,8-octafluoro-2,2-dimethyloct-3-en-3-yl]benzene
CID 100930806
[(E)-(2,2-dimethyl-4,4-diphenylbut-3-enylidene)amino] benzoate
CID 15636099
(E)-2-ethenyl-N-methoxy-2-methyl-4,4-diphenylbut-3-en-1-imine
CID 10979181

Frequently Asked Questions

What is the IUPAC name of (3,3-difluoro-1-phenylbut-1-enyl)benzene?
The IUPAC name of (3,3-difluoro-1-phenylbut-1-enyl)benzene (CID 174901374) is (3,3-difluoro-1-phenylbut-1-enyl)benzene.
What is the SMILES notation for (3,3-difluoro-1-phenylbut-1-enyl)benzene?
The canonical SMILES for (3,3-difluoro-1-phenylbut-1-enyl)benzene is CC(F)(F)C=C(c1ccccc1)c1ccccc1.
What is the InChIKey of (3,3-difluoro-1-phenylbut-1-enyl)benzene?
The InChIKey is IVDQMJSTIDWSOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F2/c1-16(17,18)12-15(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-12H,1H3.
What are the key properties of (3,3-difluoro-1-phenylbut-1-enyl)benzene?
(3,3-difluoro-1-phenylbut-1-enyl)benzene has a molecular weight of 244.28 g/mol, XLogP of 4.77, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3,3-difluoro-1-phenylbut-1-enyl)benzene is sourced from PubChem (CID 174901374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).