[4-methoxy-2-(trifluoromethyl)phenyl]methanol

C9H9F3O2 — CID 46737573

IUPAC[4-methoxy-2-(trifluoromethyl)phenyl]methanol
SMILESCOc1ccc(CO)c(C(F)(F)F)c1
InChIInChI=1S/C9H9F3O2/c1-14-7-3-2-6(5-13)8(4-7)9(10,11)12/h2-4,13H,5H2,1H3
InChIKeyMEQLJIHKRJZDPW-UHFFFAOYSA-N
MW206.16 g/mol
LogP2.21
Rot. Bonds2

About [4-methoxy-2-(trifluoromethyl)phenyl]methanol

[4-methoxy-2-(trifluoromethyl)phenyl]methanol (PubChem CID 46737573) has the molecular formula C9H9F3O2 and a molecular weight of 206.16 g/mol. Its IUPAC name is [4-methoxy-2-(trifluoromethyl)phenyl]methanol.

Molecular Properties

Compound Name[4-methoxy-2-(trifluoromethyl)phenyl]methanol
PubChem CID46737573
Molecular FormulaC9H9F3O2
Molecular Weight206.16 g/mol
Exact Mass206.06
IUPAC Name[4-methoxy-2-(trifluoromethyl)phenyl]methanol
SMILESCOc1ccc(CO)c(C(F)(F)F)c1
InChIInChI=1S/C9H9F3O2/c1-14-7-3-2-6(5-13)8(4-7)9(10,11)12/h2-4,13H,5H2,1H3
InChIKeyMEQLJIHKRJZDPW-UHFFFAOYSA-N
XLogP2.21
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.16
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

CID 7738
CID 7738
CID 16928
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CID 7118
CID 7118
CID 69705
CID 69705
CID 79406
CID 79406
CID 40003
CID 40003
CID 92218
CID 92218
CID 198104
CID 198104
CID 3016654
CID 3016654
CID 81437
CID 81437
CID 81911
CID 81911
CID 244560
CID 244560

Frequently Asked Questions

What is the IUPAC name of [4-methoxy-2-(trifluoromethyl)phenyl]methanol?
The IUPAC name of [4-methoxy-2-(trifluoromethyl)phenyl]methanol (CID 46737573) is [4-methoxy-2-(trifluoromethyl)phenyl]methanol.
What is the SMILES notation for [4-methoxy-2-(trifluoromethyl)phenyl]methanol?
The canonical SMILES for [4-methoxy-2-(trifluoromethyl)phenyl]methanol is COc1ccc(CO)c(C(F)(F)F)c1.
What is the InChIKey of [4-methoxy-2-(trifluoromethyl)phenyl]methanol?
The InChIKey is MEQLJIHKRJZDPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9F3O2/c1-14-7-3-2-6(5-13)8(4-7)9(10,11)12/h2-4,13H,5H2,1H3.
What are the key properties of [4-methoxy-2-(trifluoromethyl)phenyl]methanol?
[4-methoxy-2-(trifluoromethyl)phenyl]methanol has a molecular weight of 206.16 g/mol, XLogP of 2.21, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methoxy-2-(trifluoromethyl)phenyl]methanol is sourced from PubChem (CID 46737573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).