2-chloro-1-fluoro-3-phenoxybenzene

C12H8ClFO — CID 155282374

IUPAC2-chloro-1-fluoro-3-phenoxybenzene
SMILESFc1cccc(Oc2ccccc2)c1Cl
InChIInChI=1S/C12H8ClFO/c13-12-10(14)7-4-8-11(12)15-9-5-2-1-3-6-9/h1-8H
InChIKeyCRGZVZYNTFTMAU-UHFFFAOYSA-N
MW222.65 g/mol
LogP4.27
Rot. Bonds2

About 2-chloro-1-fluoro-3-phenoxybenzene

2-chloro-1-fluoro-3-phenoxybenzene (PubChem CID 155282374) has the molecular formula C12H8ClFO and a molecular weight of 222.65 g/mol. Its IUPAC name is 2-chloro-1-fluoro-3-phenoxybenzene.

Molecular Properties

Compound Name2-chloro-1-fluoro-3-phenoxybenzene
PubChem CID155282374
Molecular FormulaC12H8ClFO
Molecular Weight222.65 g/mol
Exact Mass222.02
IUPAC Name2-chloro-1-fluoro-3-phenoxybenzene
SMILESFc1cccc(Oc2ccccc2)c1Cl
InChIInChI=1S/C12H8ClFO/c13-12-10(14)7-4-8-11(12)15-9-5-2-1-3-6-9/h1-8H
InChIKeyCRGZVZYNTFTMAU-UHFFFAOYSA-N
XLogP4.27
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.65
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-chloro-1-fluoro-3-(4-methylphenoxy)benzene;ethane
CID 176946301
ethane;1-fluoro-2-phenoxybenzene
CID 170962676
2-fluoro-6-phenoxybenzoyl chloride
CID 156864797
1-fluoro-2-[3-[4-[4-[3-(2-fluorophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]benzene
CID 22338576
(2-chloro-3-phenoxyphenyl)methanol
CID 157201139
1-fluoro-2-methyl-3-(3-phenoxyphenoxy)benzene
CID 141038647
1,3-diphenoxy-2-phenylbenzene
CID 88611434
azane;1-chloro-2-phenoxybenzene
CID 68980819
1-(2-fluoro-6-phenoxyphenyl)ethane-1,2-diamine
CID 170894788
2-chloro-6-phenoxybenzaldehyde
CID 18663602
1-(chloromethyl)-2-fluoro-3-phenoxybenzene
CID 141096763
1-chloro-2-methyl-3-phenoxybenzene
CID 54026510

Frequently Asked Questions

What is the IUPAC name of 2-chloro-1-fluoro-3-phenoxybenzene?
The IUPAC name of 2-chloro-1-fluoro-3-phenoxybenzene (CID 155282374) is 2-chloro-1-fluoro-3-phenoxybenzene.
What is the SMILES notation for 2-chloro-1-fluoro-3-phenoxybenzene?
The canonical SMILES for 2-chloro-1-fluoro-3-phenoxybenzene is Fc1cccc(Oc2ccccc2)c1Cl.
What is the InChIKey of 2-chloro-1-fluoro-3-phenoxybenzene?
The InChIKey is CRGZVZYNTFTMAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8ClFO/c13-12-10(14)7-4-8-11(12)15-9-5-2-1-3-6-9/h1-8H.
What are the key properties of 2-chloro-1-fluoro-3-phenoxybenzene?
2-chloro-1-fluoro-3-phenoxybenzene has a molecular weight of 222.65 g/mol, XLogP of 4.27, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-1-fluoro-3-phenoxybenzene is sourced from PubChem (CID 155282374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).