ethane;1-fluoro-2-phenoxybenzene

C14H15FO — CID 170962676

IUPACethane;1-fluoro-2-phenoxybenzene
SMILESCC.Fc1ccccc1Oc1ccccc1
InChIInChI=1S/C12H9FO.C2H6/c13-11-8-4-5-9-12(11)14-10-6-2-1-3-7-10;1-2/h1-9H;1-2H3
InChIKeyAWYWTAUTZQSTSN-UHFFFAOYSA-N
MW218.27 g/mol
LogP4.64
Rot. Bonds2

About ethane;1-fluoro-2-phenoxybenzene

ethane;1-fluoro-2-phenoxybenzene (PubChem CID 170962676) has the molecular formula C14H15FO and a molecular weight of 218.27 g/mol. Its IUPAC name is ethane;1-fluoro-2-phenoxybenzene.

Molecular Properties

Compound Nameethane;1-fluoro-2-phenoxybenzene
PubChem CID170962676
Molecular FormulaC14H15FO
Molecular Weight218.27 g/mol
Exact Mass218.11
IUPAC Nameethane;1-fluoro-2-phenoxybenzene
SMILESCC.Fc1ccccc1Oc1ccccc1
InChIInChI=1S/C12H9FO.C2H6/c13-11-8-4-5-9-12(11)14-10-6-2-1-3-7-10;1-2/h1-9H;1-2H3
InChIKeyAWYWTAUTZQSTSN-UHFFFAOYSA-N
XLogP4.64
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.27
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-fluoro-2-[3-[4-[4-[3-(2-fluorophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]benzene
CID 22338576
1,2-bis[2-[2-(2-fluorophenoxy)phenoxy]phenoxy]benzene
CID 22338502
2-chloro-1-fluoro-3-phenoxybenzene
CID 155282374
1-fluoro-2-methyl-3-(3-phenoxyphenoxy)benzene
CID 141038647
ethane;1-methyl-2-phenoxybenzene
CID 90950955
1-[4-(2-fluorophenoxy)phenyl]-N,N-dimethylmethanamine
CID 145011426
1-fluoro-4-methoxy-2-phenoxybenzene
CID 162127309
1-(chloromethyl)-4-(2-fluorophenoxy)benzene
CID 22293096
(1R)-1-[4-(2-fluorophenoxy)phenyl]propan-1-amine
CID 113247632
3-(2-fluorophenoxy)-1-oxidopyridin-1-ium
CID 54105304
1-phenoxy-2-[2-(2-phenoxyphenyl)propan-2-yl]benzene
CID 19890139
3-[4-(2-fluorophenoxy)phenyl]butanoic acid
CID 82306805

Frequently Asked Questions

What is the IUPAC name of ethane;1-fluoro-2-phenoxybenzene?
The IUPAC name of ethane;1-fluoro-2-phenoxybenzene (CID 170962676) is ethane;1-fluoro-2-phenoxybenzene.
What is the SMILES notation for ethane;1-fluoro-2-phenoxybenzene?
The canonical SMILES for ethane;1-fluoro-2-phenoxybenzene is CC.Fc1ccccc1Oc1ccccc1.
What is the InChIKey of ethane;1-fluoro-2-phenoxybenzene?
The InChIKey is AWYWTAUTZQSTSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9FO.C2H6/c13-11-8-4-5-9-12(11)14-10-6-2-1-3-7-10;1-2/h1-9H;1-2H3.
What are the key properties of ethane;1-fluoro-2-phenoxybenzene?
ethane;1-fluoro-2-phenoxybenzene has a molecular weight of 218.27 g/mol, XLogP of 4.64, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-fluoro-2-phenoxybenzene is sourced from PubChem (CID 170962676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).