1-(1,1-difluoroethyl)-4-ethenylbenzene

C10H10F2 — CID 59554717

IUPAC1-(1,1-difluoroethyl)-4-ethenylbenzene
SMILESC=Cc1ccc(C(C)(F)F)cc1
InChIInChI=1S/C10H10F2/c1-3-8-4-6-9(7-5-8)10(2,11)12/h3-7H,1H2,2H3
InChIKeyVHCQGLFGAKVZCT-UHFFFAOYSA-N
MW168.19 g/mol
LogP3.44
Rot. Bonds2

About 1-(1,1-difluoroethyl)-4-ethenylbenzene

1-(1,1-difluoroethyl)-4-ethenylbenzene (PubChem CID 59554717) has the molecular formula C10H10F2 and a molecular weight of 168.19 g/mol. Its IUPAC name is 1-(1,1-difluoroethyl)-4-ethenylbenzene.

Molecular Properties

Compound Name1-(1,1-difluoroethyl)-4-ethenylbenzene
PubChem CID59554717
Molecular FormulaC10H10F2
Molecular Weight168.19 g/mol
Exact Mass168.08
IUPAC Name1-(1,1-difluoroethyl)-4-ethenylbenzene
SMILESC=Cc1ccc(C(C)(F)F)cc1
InChIInChI=1S/C10H10F2/c1-3-8-4-6-9(7-5-8)10(2,11)12/h3-7H,1H2,2H3
InChIKeyVHCQGLFGAKVZCT-UHFFFAOYSA-N
XLogP3.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.19
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-tert-butyl-4-ethenylbenzene
CID 15627
1-ethenyl-4-(1,1,2,2,2-pentafluoroethyl)benzene
CID 18928984
1-(2-chloropropan-2-yl)-4-ethenylbenzene
CID 19761581
2-(4-ethenylphenyl)propan-2-amine;hydrochloride
CID 173390988
4-ethenyl-N-[4-[2-[4-(4-ethenylanilino)phenyl]-1,1,1-trifluoropropan-2-yl]phenyl]aniline
CID 137446475
1-(1,1-dimethoxyethyl)-4-ethenylbenzene
CID 174389278
1-tert-butyl-4-ethenylbenzene;4-ethenylphenol;styrene
CID 174491340
1-tert-butyl-4-ethenylbenzene;trifluoromethyl 2-methylprop-2-enoate
CID 158477924
1-(3,4-dimethylpent-1-en-3-yl)-4-ethenylbenzene
CID 144582721
2-(4-ethenylphenyl)-2,2-difluoroacetic acid
CID 154126717
(4-ethenylphenyl)-difluoromethanesulfonamide
CID 175410018
(4-ethenylphenyl)-difluoromethanesulfonate
CID 59554748

Frequently Asked Questions

What is the IUPAC name of 1-(1,1-difluoroethyl)-4-ethenylbenzene?
The IUPAC name of 1-(1,1-difluoroethyl)-4-ethenylbenzene (CID 59554717) is 1-(1,1-difluoroethyl)-4-ethenylbenzene.
What is the SMILES notation for 1-(1,1-difluoroethyl)-4-ethenylbenzene?
The canonical SMILES for 1-(1,1-difluoroethyl)-4-ethenylbenzene is C=Cc1ccc(C(C)(F)F)cc1.
What is the InChIKey of 1-(1,1-difluoroethyl)-4-ethenylbenzene?
The InChIKey is VHCQGLFGAKVZCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F2/c1-3-8-4-6-9(7-5-8)10(2,11)12/h3-7H,1H2,2H3.
What are the key properties of 1-(1,1-difluoroethyl)-4-ethenylbenzene?
1-(1,1-difluoroethyl)-4-ethenylbenzene has a molecular weight of 168.19 g/mol, XLogP of 3.44, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,1-difluoroethyl)-4-ethenylbenzene is sourced from PubChem (CID 59554717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).