[2-ethoxy-4-(trifluoromethoxy)phenyl]methanol

C10H11F3O3 — CID 170997954

IUPAC[2-ethoxy-4-(trifluoromethoxy)phenyl]methanol
SMILESCCOc1cc(OC(F)(F)F)ccc1CO
InChIInChI=1S/C10H11F3O3/c1-2-15-9-5-8(16-10(11,12)13)4-3-7(9)6-14/h3-5,14H,2,6H2,1H3
InChIKeyXPZOTALCTSFFSG-UHFFFAOYSA-N
MW236.19 g/mol
LogP2.48
Rot. Bonds4

About [2-ethoxy-4-(trifluoromethoxy)phenyl]methanol

[2-ethoxy-4-(trifluoromethoxy)phenyl]methanol (PubChem CID 170997954) has the molecular formula C10H11F3O3 and a molecular weight of 236.19 g/mol. Its IUPAC name is [2-ethoxy-4-(trifluoromethoxy)phenyl]methanol.

Molecular Properties

Compound Name[2-ethoxy-4-(trifluoromethoxy)phenyl]methanol
PubChem CID170997954
Molecular FormulaC10H11F3O3
Molecular Weight236.19 g/mol
Exact Mass236.07
IUPAC Name[2-ethoxy-4-(trifluoromethoxy)phenyl]methanol
SMILESCCOc1cc(OC(F)(F)F)ccc1CO
InChIInChI=1S/C10H11F3O3/c1-2-15-9-5-8(16-10(11,12)13)4-3-7(9)6-14/h3-5,14H,2,6H2,1H3
InChIKeyXPZOTALCTSFFSG-UHFFFAOYSA-N
XLogP2.48
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.19
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-ethoxy-4-methoxyphenyl)methanol
CID 61267380
[2-(hydroxymethyl)-5-(trifluoromethoxy)phenyl]boronic acid
CID 131676982
ethyl 2-[2-ethoxy-5-(trifluoromethoxy)phenyl]acetate
CID 170998059
methyl 2-[2-ethoxy-5-(trifluoromethoxy)phenyl]acetate
CID 170998049
2-ethoxy-5-(trifluoromethoxy)benzoate
CID 170682099
2-[4-ethoxy-2-(trifluoromethoxy)phenyl]acetic acid
CID 170999024
2-ethoxy-5-(trifluoromethoxy)benzamide
CID 170997994
1-bromo-1-[2-ethoxy-4-(trifluoromethoxy)phenyl]propan-2-one
CID 134615758
2-(hydroxymethyl)-4-(trifluoromethoxy)phenol
CID 11694149
2-(chloromethyl)-1-ethyl-4-(trifluoromethoxy)benzene
CID 170998693
1-bromo-1-[2-ethoxy-5-(trifluoromethoxy)phenyl]propan-2-one
CID 134615762
3-bromo-1-[2-ethoxy-5-(trifluoromethoxy)phenyl]propan-1-one
CID 134624533

Frequently Asked Questions

What is the IUPAC name of [2-ethoxy-4-(trifluoromethoxy)phenyl]methanol?
The IUPAC name of [2-ethoxy-4-(trifluoromethoxy)phenyl]methanol (CID 170997954) is [2-ethoxy-4-(trifluoromethoxy)phenyl]methanol.
What is the SMILES notation for [2-ethoxy-4-(trifluoromethoxy)phenyl]methanol?
The canonical SMILES for [2-ethoxy-4-(trifluoromethoxy)phenyl]methanol is CCOc1cc(OC(F)(F)F)ccc1CO.
What is the InChIKey of [2-ethoxy-4-(trifluoromethoxy)phenyl]methanol?
The InChIKey is XPZOTALCTSFFSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F3O3/c1-2-15-9-5-8(16-10(11,12)13)4-3-7(9)6-14/h3-5,14H,2,6H2,1H3.
What are the key properties of [2-ethoxy-4-(trifluoromethoxy)phenyl]methanol?
[2-ethoxy-4-(trifluoromethoxy)phenyl]methanol has a molecular weight of 236.19 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-ethoxy-4-(trifluoromethoxy)phenyl]methanol is sourced from PubChem (CID 170997954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).