2,4-bis(2-fluoroethoxy)-1-methylbenzene

C11H14F2O2 — CID 15058706

IUPAC2,4-bis(2-fluoroethoxy)-1-methylbenzene
SMILESCc1ccc(OCCF)cc1OCCF
InChIInChI=1S/C11H14F2O2/c1-9-2-3-10(14-6-4-12)8-11(9)15-7-5-13/h2-3,8H,4-7H2,1H3
InChIKeyBNYUHHVSLFUWFK-UHFFFAOYSA-N
MW216.23 g/mol
LogP2.69
Rot. Bonds6

About 2,4-bis(2-fluoroethoxy)-1-methylbenzene

2,4-bis(2-fluoroethoxy)-1-methylbenzene (PubChem CID 15058706) has the molecular formula C11H14F2O2 and a molecular weight of 216.23 g/mol. Its IUPAC name is 2,4-bis(2-fluoroethoxy)-1-methylbenzene.

Molecular Properties

Compound Name2,4-bis(2-fluoroethoxy)-1-methylbenzene
PubChem CID15058706
Molecular FormulaC11H14F2O2
Molecular Weight216.23 g/mol
Exact Mass216.10
IUPAC Name2,4-bis(2-fluoroethoxy)-1-methylbenzene
SMILESCc1ccc(OCCF)cc1OCCF
InChIInChI=1S/C11H14F2O2/c1-9-2-3-10(14-6-4-12)8-11(9)15-7-5-13/h2-3,8H,4-7H2,1H3
InChIKeyBNYUHHVSLFUWFK-UHFFFAOYSA-N
XLogP2.69
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.23
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,4-bis(fluoromethoxy)-1-methylbenzene
CID 57232585
4-methoxy-2-(3-methoxypropoxy)-1-methylbenzene
CID 59177328
ethane;1-(2-fluoroethoxy)-4-methylbenzene
CID 142309231
[4-[2-(5-fluoro-2-methylphenoxy)ethoxy]phenyl]methanamine
CID 102980810
1-(bromomethyl)-2-(2-fluoroethoxy)-4-methoxybenzene
CID 80694443
3-(3-fluoropropoxy)-4-methylaniline
CID 81107122
[5-(2-iodooxyethoxy)-2-methylphenyl] hypoiodite
CID 142869451
4-[2-(3,4-dimethylphenoxy)ethoxy]-1,2-dimethylbenzene
CID 2195047
5-[3-(2,5-dimethylphenoxy)propoxy]-2-methylaniline
CID 82097167
[4-[2-(2,5-dimethylphenoxy)ethoxy]phenyl]methanamine
CID 20988768
4-(2-fluoroethoxy)-2-methylbenzenesulfonamide
CID 80694123
2-fluoro-1-(2-fluoroethoxy)-5-methoxy-3-methylbenzene
CID 89017823

Frequently Asked Questions

What is the IUPAC name of 2,4-bis(2-fluoroethoxy)-1-methylbenzene?
The IUPAC name of 2,4-bis(2-fluoroethoxy)-1-methylbenzene (CID 15058706) is 2,4-bis(2-fluoroethoxy)-1-methylbenzene.
What is the SMILES notation for 2,4-bis(2-fluoroethoxy)-1-methylbenzene?
The canonical SMILES for 2,4-bis(2-fluoroethoxy)-1-methylbenzene is Cc1ccc(OCCF)cc1OCCF.
What is the InChIKey of 2,4-bis(2-fluoroethoxy)-1-methylbenzene?
The InChIKey is BNYUHHVSLFUWFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F2O2/c1-9-2-3-10(14-6-4-12)8-11(9)15-7-5-13/h2-3,8H,4-7H2,1H3.
What are the key properties of 2,4-bis(2-fluoroethoxy)-1-methylbenzene?
2,4-bis(2-fluoroethoxy)-1-methylbenzene has a molecular weight of 216.23 g/mol, XLogP of 2.69, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-bis(2-fluoroethoxy)-1-methylbenzene is sourced from PubChem (CID 15058706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).