methane;1-methyl-4-(trifluoromethoxy)benzene

C10H15F3O — CID 160675977

IUPACmethane;1-methyl-4-(trifluoromethoxy)benzene
SMILESC.C.Cc1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C8H7F3O.2CH4/c1-6-2-4-7(5-3-6)12-8(9,10)11;;/h2-5H,1H3;2*1H4
InChIKeyRNNLZXPXHWDJAK-UHFFFAOYSA-N
MW208.22 g/mol
LogP4.17
Rot. Bonds1

About methane;1-methyl-4-(trifluoromethoxy)benzene

methane;1-methyl-4-(trifluoromethoxy)benzene (PubChem CID 160675977) has the molecular formula C10H15F3O and a molecular weight of 208.22 g/mol. Its IUPAC name is methane;1-methyl-4-(trifluoromethoxy)benzene.

Molecular Properties

Compound Namemethane;1-methyl-4-(trifluoromethoxy)benzene
PubChem CID160675977
Molecular FormulaC10H15F3O
Molecular Weight208.22 g/mol
Exact Mass208.11
IUPAC Namemethane;1-methyl-4-(trifluoromethoxy)benzene
SMILESC.C.Cc1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C8H7F3O.2CH4/c1-6-2-4-7(5-3-6)12-8(9,10)11;;/h2-5H,1H3;2*1H4
InChIKeyRNNLZXPXHWDJAK-UHFFFAOYSA-N
XLogP4.17
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

methanamine;1-methyl-4-(trifluoromethoxy)benzene
CID 142968815
ethane;1-fluoro-4-methylbenzene;1-methyl-4-(trifluoromethoxy)benzene
CID 144678762
2,4-dimethyl-1-[4-[4-(trifluoromethoxy)phenyl]phenoxy]benzene
CID 67122277
dimethyl-[4-(trifluoromethoxy)phenyl]-λ3-iodane
CID 162561670
2-(4-methylphenyl)-5-(trifluoromethoxy)aniline
CID 146015319
1-ethyl-4-[4-(trifluoromethoxy)phenyl]benzene
CID 19436313
1-(chloromethyl)-4-methyl-2-[4-(trifluoromethoxy)phenyl]benzene
CID 170552809
1-methyl-4-[1-[4-(trifluoromethoxy)phenyl]ethylsulfonyl]benzene
CID 122600808
[4-(trifluoromethoxy)phenyl] (Z)-2,3-difluoro-3-(4-methylphenyl)prop-2-enoate
CID 23565882
[4-(trifluoromethoxy)phenyl] (E)-2,3-difluoro-3-(4-methylphenyl)prop-2-enoate
CID 59039923
1-methoxy-4-[4-[4-(trifluoromethoxy)phenoxy]phenyl]benzene
CID 59726185
1-methyl-4-(1,1,2,2,3-pentafluoropropoxy)benzene
CID 54236481

Frequently Asked Questions

What is the IUPAC name of methane;1-methyl-4-(trifluoromethoxy)benzene?
The IUPAC name of methane;1-methyl-4-(trifluoromethoxy)benzene (CID 160675977) is methane;1-methyl-4-(trifluoromethoxy)benzene.
What is the SMILES notation for methane;1-methyl-4-(trifluoromethoxy)benzene?
The canonical SMILES for methane;1-methyl-4-(trifluoromethoxy)benzene is C.C.Cc1ccc(OC(F)(F)F)cc1.
What is the InChIKey of methane;1-methyl-4-(trifluoromethoxy)benzene?
The InChIKey is RNNLZXPXHWDJAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F3O.2CH4/c1-6-2-4-7(5-3-6)12-8(9,10)11;;/h2-5H,1H3;2*1H4.
What are the key properties of methane;1-methyl-4-(trifluoromethoxy)benzene?
methane;1-methyl-4-(trifluoromethoxy)benzene has a molecular weight of 208.22 g/mol, XLogP of 4.17, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methane;1-methyl-4-(trifluoromethoxy)benzene is sourced from PubChem (CID 160675977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).