2-fluoro-2,2-bis(4-fluorophenyl)acetate

C14H8F3O2- — CID 20636369

IUPAC2-fluoro-2,2-bis(4-fluorophenyl)acetate
SMILESO=C([O-])C(F)(c1ccc(F)cc1)c1ccc(F)cc1
InChIInChI=1S/C14H9F3O2/c15-11-5-1-9(2-6-11)14(17,13(18)19)10-3-7-12(16)8-4-10/h1-8H,(H,18,19)/p-1
InChIKeyQUGCBYYZBQECCE-UHFFFAOYSA-M
MW265.21 g/mol
LogP1.93
Rot. Bonds3

About 2-fluoro-2,2-bis(4-fluorophenyl)acetate

2-fluoro-2,2-bis(4-fluorophenyl)acetate (PubChem CID 20636369) has the molecular formula C14H8F3O2- and a molecular weight of 265.21 g/mol. Its IUPAC name is 2-fluoro-2,2-bis(4-fluorophenyl)acetate.

Molecular Properties

Compound Name2-fluoro-2,2-bis(4-fluorophenyl)acetate
PubChem CID20636369
Molecular FormulaC14H8F3O2-
Molecular Weight265.21 g/mol
Exact Mass265.05
IUPAC Name2-fluoro-2,2-bis(4-fluorophenyl)acetate
SMILESO=C([O-])C(F)(c1ccc(F)cc1)c1ccc(F)cc1
InChIInChI=1S/C14H9F3O2/c15-11-5-1-9(2-6-11)14(17,13(18)19)10-3-7-12(16)8-4-10/h1-8H,(H,18,19)/p-1
InChIKeyQUGCBYYZBQECCE-UHFFFAOYSA-M
XLogP1.93
TPSA40.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.21
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

bromomethane;2-fluoro-2,2-bis(4-fluorophenyl)acetate
CID 20636363
2-fluoro-2-(4-fluorophenyl)propanedioic acid
CID 139618704
1,1-difluoro-1-(4-fluorophenyl)propan-2-one
CID 83854791
2,2,2-tris(4-fluorophenyl)acetic acid
CID 91545050
2,2-bis(4-fluorophenyl)-2-sulfanylacetamide
CID 87771670
2,2-difluoro-2-[4-(4-fluorophenyl)phenoxy]acetate
CID 162451027
tris(4-fluorophenyl)methyl 2,2,2-trifluoroacetate
CID 71429877
bismuth tris(2,2,2-tris[4-(trifluoromethyl)phenyl]acetate)
CID 173320339
copper bis(4-fluorobenzoate)
CID 70452334
2-amino-2-(4-fluorophenyl)-2-hydroxyacetic acid
CID 70123452
2-amino-3-fluoro-2-(4-fluorophenyl)-3-methylbutanoic acid
CID 105486323
1-[4-[1,1,1,3,3,3-hexafluoro-2-(4-fluorophenyl)propan-2-yl]phenyl]ethanone
CID 21200809

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2,2-bis(4-fluorophenyl)acetate?
The IUPAC name of 2-fluoro-2,2-bis(4-fluorophenyl)acetate (CID 20636369) is 2-fluoro-2,2-bis(4-fluorophenyl)acetate.
What is the SMILES notation for 2-fluoro-2,2-bis(4-fluorophenyl)acetate?
The canonical SMILES for 2-fluoro-2,2-bis(4-fluorophenyl)acetate is O=C([O-])C(F)(c1ccc(F)cc1)c1ccc(F)cc1.
What is the InChIKey of 2-fluoro-2,2-bis(4-fluorophenyl)acetate?
The InChIKey is QUGCBYYZBQECCE-UHFFFAOYSA-M. The full InChI is InChI=1S/C14H9F3O2/c15-11-5-1-9(2-6-11)14(17,13(18)19)10-3-7-12(16)8-4-10/h1-8H,(H,18,19)/p-1.
What are the key properties of 2-fluoro-2,2-bis(4-fluorophenyl)acetate?
2-fluoro-2,2-bis(4-fluorophenyl)acetate has a molecular weight of 265.21 g/mol, XLogP of 1.93, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2,2-bis(4-fluorophenyl)acetate is sourced from PubChem (CID 20636369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).