4-(fluoromethyl)-3-methoxyphenol

C8H9FO2 — CID 91883535

IUPAC4-(fluoromethyl)-3-methoxyphenol
SMILESCOc1cc(O)ccc1CF
InChIInChI=1S/C8H9FO2/c1-11-8-4-7(10)3-2-6(8)5-9/h2-4,10H,5H2,1H3
InChIKeyUOJPSPCECKNMNR-UHFFFAOYSA-N
MW156.16 g/mol
LogP1.87
Rot. Bonds2

About 4-(fluoromethyl)-3-methoxyphenol

4-(fluoromethyl)-3-methoxyphenol (PubChem CID 91883535) has the molecular formula C8H9FO2 and a molecular weight of 156.16 g/mol. Its IUPAC name is 4-(fluoromethyl)-3-methoxyphenol.

Molecular Properties

Compound Name4-(fluoromethyl)-3-methoxyphenol
PubChem CID91883535
Molecular FormulaC8H9FO2
Molecular Weight156.16 g/mol
Exact Mass156.06
IUPAC Name4-(fluoromethyl)-3-methoxyphenol
SMILESCOc1cc(O)ccc1CF
InChIInChI=1S/C8H9FO2/c1-11-8-4-7(10)3-2-6(8)5-9/h2-4,10H,5H2,1H3
InChIKeyUOJPSPCECKNMNR-UHFFFAOYSA-N
XLogP1.87
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.16
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(hydroxymethyl)-3-methoxyphenol
CID 3759783
4-[3-(dimethylamino)propyl]-3-methoxyphenol
CID 170865239
(4-hydroxy-2-methoxyphenyl)methanesulfonyl chloride
CID 117345788
ethane;4-(fluoromethyl)benzene-1,3-diol
CID 172565118
ethyl 2-(4-hydroxy-2-methoxyphenyl)acetate
CID 105463832
3-methoxy-4-[(4-methylphenoxy)methyl]phenol
CID 117219725
4-(fluoromethyl)benzene-1,3-diol
CID 91883667
3-methoxy-4-(propan-2-ylsulfonylmethyl)phenol
CID 117219444
1,3-bis(4-hydroxy-2-methoxyphenyl)propan-1-one
CID 139808083
4-[(2-bromophenoxy)methyl]-3-methoxyphenol
CID 117219537
3-fluoro-4-methoxyphenol
CID 14661613
4-methoxy-3-(2,2,2-trifluoroethoxy)phenol
CID 167312142

Frequently Asked Questions

What is the IUPAC name of 4-(fluoromethyl)-3-methoxyphenol?
The IUPAC name of 4-(fluoromethyl)-3-methoxyphenol (CID 91883535) is 4-(fluoromethyl)-3-methoxyphenol.
What is the SMILES notation for 4-(fluoromethyl)-3-methoxyphenol?
The canonical SMILES for 4-(fluoromethyl)-3-methoxyphenol is COc1cc(O)ccc1CF.
What is the InChIKey of 4-(fluoromethyl)-3-methoxyphenol?
The InChIKey is UOJPSPCECKNMNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9FO2/c1-11-8-4-7(10)3-2-6(8)5-9/h2-4,10H,5H2,1H3.
What are the key properties of 4-(fluoromethyl)-3-methoxyphenol?
4-(fluoromethyl)-3-methoxyphenol has a molecular weight of 156.16 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(fluoromethyl)-3-methoxyphenol is sourced from PubChem (CID 91883535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).