fluoro 2-(2-fluorophenyl)acetate

C8H6F2O2 — CID 143971314

IUPACfluoro 2-(2-fluorophenyl)acetate
SMILESO=C(Cc1ccccc1F)OF
InChIInChI=1S/C8H6F2O2/c9-7-4-2-1-3-6(7)5-8(11)12-10/h1-4H,5H2
InChIKeyHTDUYPBUNCFOEO-UHFFFAOYSA-N
MW172.13 g/mol
LogP1.80
Rot. Bonds2

About fluoro 2-(2-fluorophenyl)acetate

fluoro 2-(2-fluorophenyl)acetate (PubChem CID 143971314) has the molecular formula C8H6F2O2 and a molecular weight of 172.13 g/mol. Its IUPAC name is fluoro 2-(2-fluorophenyl)acetate.

Molecular Properties

Compound Namefluoro 2-(2-fluorophenyl)acetate
PubChem CID143971314
Molecular FormulaC8H6F2O2
Molecular Weight172.13 g/mol
Exact Mass172.03
IUPAC Namefluoro 2-(2-fluorophenyl)acetate
SMILESO=C(Cc1ccccc1F)OF
InChIInChI=1S/C8H6F2O2/c9-7-4-2-1-3-6(7)5-8(11)12-10/h1-4H,5H2
InChIKeyHTDUYPBUNCFOEO-UHFFFAOYSA-N
XLogP1.80
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.13
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2,3,4,5,6-pentafluorophenyl) 2-(2-fluorophenyl)acetate
CID 154723270
[4-[[2-(2-fluorophenyl)acetyl]oxymethyl]phenyl]methyl 2-(2-fluorophenyl)acetate
CID 23737434
carbonic acid;1-ethyl-2-fluorobenzene
CID 174964119
2-(2-fluorophenyl)acetamide;hydrochloride
CID 68904503
cyclohexyl 2-(2-fluorophenyl)acetate
CID 78840084
2-deuterio-2-(2-fluorophenyl)acetic acid
CID 139238506
(2-fluorophenyl)methyl 2-[2-(aminomethyl)phenyl]acetate
CID 81317645
[2-(4-chlorophenyl)-2-oxoethyl] 2-(2-fluorophenyl)acetate
CID 23904314
propan-2-yl 3-(2-fluorophenyl)-2-oxopropanoate
CID 18370977
1-(2-fluorophenyl)-3-phenoxypropan-2-one
CID 43799913
1,5-bis(2-fluorophenyl)pentan-3-one
CID 70057472
(1-bromonaphthalen-2-yl) 2-(2-fluorophenyl)acetate
CID 7918557

Frequently Asked Questions

What is the IUPAC name of fluoro 2-(2-fluorophenyl)acetate?
The IUPAC name of fluoro 2-(2-fluorophenyl)acetate (CID 143971314) is fluoro 2-(2-fluorophenyl)acetate.
What is the SMILES notation for fluoro 2-(2-fluorophenyl)acetate?
The canonical SMILES for fluoro 2-(2-fluorophenyl)acetate is O=C(Cc1ccccc1F)OF.
What is the InChIKey of fluoro 2-(2-fluorophenyl)acetate?
The InChIKey is HTDUYPBUNCFOEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6F2O2/c9-7-4-2-1-3-6(7)5-8(11)12-10/h1-4H,5H2.
What are the key properties of fluoro 2-(2-fluorophenyl)acetate?
fluoro 2-(2-fluorophenyl)acetate has a molecular weight of 172.13 g/mol, XLogP of 1.80, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for fluoro 2-(2-fluorophenyl)acetate is sourced from PubChem (CID 143971314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).