[2-(1,3-dioxolan-2-yl)-3-fluorophenyl]-(2-fluorophenyl)methanone

C16H12F2O3 — CID 164915515

IUPAC[2-(1,3-dioxolan-2-yl)-3-fluorophenyl]-(2-fluorophenyl)methanone
SMILESO=C(c1ccccc1F)c1cccc(F)c1C1OCCO1
InChIInChI=1S/C16H12F2O3/c17-12-6-2-1-4-10(12)15(19)11-5-3-7-13(18)14(11)16-20-8-9-21-16/h1-7,16H,8-9H2
InChIKeyGELLOLPHSGDPIO-UHFFFAOYSA-N
MW290.26 g/mol
LogP3.24
Rot. Bonds3

About [2-(1,3-dioxolan-2-yl)-3-fluorophenyl]-(2-fluorophenyl)methanone

[2-(1,3-dioxolan-2-yl)-3-fluorophenyl]-(2-fluorophenyl)methanone (PubChem CID 164915515) has the molecular formula C16H12F2O3 and a molecular weight of 290.26 g/mol. Its IUPAC name is [2-(1,3-dioxolan-2-yl)-3-fluorophenyl]-(2-fluorophenyl)methanone.

Molecular Properties

Compound Name[2-(1,3-dioxolan-2-yl)-3-fluorophenyl]-(2-fluorophenyl)methanone
PubChem CID164915515
Molecular FormulaC16H12F2O3
Molecular Weight290.26 g/mol
Exact Mass290.08
IUPAC Name[2-(1,3-dioxolan-2-yl)-3-fluorophenyl]-(2-fluorophenyl)methanone
SMILESO=C(c1ccccc1F)c1cccc(F)c1C1OCCO1
InChIInChI=1S/C16H12F2O3/c17-12-6-2-1-4-10(12)15(19)11-5-3-7-13(18)14(11)16-20-8-9-21-16/h1-7,16H,8-9H2
InChIKeyGELLOLPHSGDPIO-UHFFFAOYSA-N
XLogP3.24
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.26
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,6-difluorophenyl)-1,3-dioxolane
CID 10511746
[2-(1,3-dioxolan-2-yl)-3-fluorophenyl]-(8-fluoroquinolin-3-yl)methanone
CID 166790938
[2-(2-fluorobenzoyl)phenyl]-(2-fluorophenyl)methanone
CID 130332183
bis(2-cyclopropyl-3-fluorophenyl)methanone
CID 73011767
(2-fluorophenyl)-(2,4,5-trifluorophenyl)methanone
CID 103301189
N-[4-(1,3-dioxolan-2-yl)phenyl]-2-fluorobenzamide
CID 110732804
[2-(1,3-dioxolan-2-yl)-3-methylphenyl]-[2-(propan-2-ylideneamino)oxyphenyl]methanone
CID 164915470
bis(2-fluorophenyl)methanone;[2-fluoro-6-(2-fluorobenzoyl)phenyl]-phenylmethanone
CID 130332180
(2-fluorophenyl)-(2,3,4-trifluorophenyl)methanone
CID 55181517
2-(2-chloro-6-fluorophenyl)-1,3-dioxane
CID 82113848
(2-fluorophenyl)-(1,2,3,4-tetrahydroquinoxalin-5-yl)methanone
CID 57287537
3-(1,3-dioxolan-2-yl)-2,4-difluorophenol
CID 21063809

Frequently Asked Questions

What is the IUPAC name of [2-(1,3-dioxolan-2-yl)-3-fluorophenyl]-(2-fluorophenyl)methanone?
The IUPAC name of [2-(1,3-dioxolan-2-yl)-3-fluorophenyl]-(2-fluorophenyl)methanone (CID 164915515) is [2-(1,3-dioxolan-2-yl)-3-fluorophenyl]-(2-fluorophenyl)methanone.
What is the SMILES notation for [2-(1,3-dioxolan-2-yl)-3-fluorophenyl]-(2-fluorophenyl)methanone?
The canonical SMILES for [2-(1,3-dioxolan-2-yl)-3-fluorophenyl]-(2-fluorophenyl)methanone is O=C(c1ccccc1F)c1cccc(F)c1C1OCCO1.
What is the InChIKey of [2-(1,3-dioxolan-2-yl)-3-fluorophenyl]-(2-fluorophenyl)methanone?
The InChIKey is GELLOLPHSGDPIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12F2O3/c17-12-6-2-1-4-10(12)15(19)11-5-3-7-13(18)14(11)16-20-8-9-21-16/h1-7,16H,8-9H2.
What are the key properties of [2-(1,3-dioxolan-2-yl)-3-fluorophenyl]-(2-fluorophenyl)methanone?
[2-(1,3-dioxolan-2-yl)-3-fluorophenyl]-(2-fluorophenyl)methanone has a molecular weight of 290.26 g/mol, XLogP of 3.24, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1,3-dioxolan-2-yl)-3-fluorophenyl]-(2-fluorophenyl)methanone is sourced from PubChem (CID 164915515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).