5-fluoro-2-(2-hydroxypropyl)-4-methoxyphenol

C10H13FO3 — CID 117289277

IUPAC5-fluoro-2-(2-hydroxypropyl)-4-methoxyphenol
SMILESCOc1cc(CC(C)O)c(O)cc1F
InChIInChI=1S/C10H13FO3/c1-6(12)3-7-4-10(14-2)8(11)5-9(7)13/h4-6,12-13H,3H2,1-2H3
InChIKeyYXMJQXNTUJDPPK-UHFFFAOYSA-N
MW200.21 g/mol
LogP1.46
Rot. Bonds3

About 5-fluoro-2-(2-hydroxypropyl)-4-methoxyphenol

5-fluoro-2-(2-hydroxypropyl)-4-methoxyphenol (PubChem CID 117289277) has the molecular formula C10H13FO3 and a molecular weight of 200.21 g/mol. Its IUPAC name is 5-fluoro-2-(2-hydroxypropyl)-4-methoxyphenol.

Molecular Properties

Compound Name5-fluoro-2-(2-hydroxypropyl)-4-methoxyphenol
PubChem CID117289277
Molecular FormulaC10H13FO3
Molecular Weight200.21 g/mol
Exact Mass200.08
IUPAC Name5-fluoro-2-(2-hydroxypropyl)-4-methoxyphenol
SMILESCOc1cc(CC(C)O)c(O)cc1F
InChIInChI=1S/C10H13FO3/c1-6(12)3-7-4-10(14-2)8(11)5-9(7)13/h4-6,12-13H,3H2,1-2H3
InChIKeyYXMJQXNTUJDPPK-UHFFFAOYSA-N
XLogP1.46
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.21
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,4-difluoro-5-methoxyphenyl)propan-2-ol
CID 117290712
5-(2-hydroxypropyl)-2,4-dimethoxyphenol
CID 117303005
4-chloro-5-fluoro-2-(2-hydroxypropyl)phenol
CID 117293006
1-[4-(fluoromethyl)-2,5-dimethoxyphenyl]propan-2-ol
CID 117328887
5-bromo-4-(2-hydroxypropyl)-2-methoxyphenol
CID 117406460
1-(5-ethyl-4-fluoro-2-methoxyphenyl)propan-2-ol
CID 117303123
1-(4-fluoro-2-methoxyphenyl)propan-2-ol
CID 83675442
4-(bromomethyl)-5-fluoro-2-methoxyphenol
CID 130756651
2,4-difluoro-3-(2-hydroxypropyl)-5-methoxyphenol
CID 117310551
1-(3-chloro-2-fluoro-4,5-dimethoxyphenyl)propan-2-ol
CID 117374936
2-bromo-4-fluoro-6-(2-hydroxypropyl)phenol
CID 117375107
2-bromo-4-fluoro-3-(2-hydroxypropyl)-6-methoxyphenol
CID 117447325

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-(2-hydroxypropyl)-4-methoxyphenol?
The IUPAC name of 5-fluoro-2-(2-hydroxypropyl)-4-methoxyphenol (CID 117289277) is 5-fluoro-2-(2-hydroxypropyl)-4-methoxyphenol.
What is the SMILES notation for 5-fluoro-2-(2-hydroxypropyl)-4-methoxyphenol?
The canonical SMILES for 5-fluoro-2-(2-hydroxypropyl)-4-methoxyphenol is COc1cc(CC(C)O)c(O)cc1F.
What is the InChIKey of 5-fluoro-2-(2-hydroxypropyl)-4-methoxyphenol?
The InChIKey is YXMJQXNTUJDPPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FO3/c1-6(12)3-7-4-10(14-2)8(11)5-9(7)13/h4-6,12-13H,3H2,1-2H3.
What are the key properties of 5-fluoro-2-(2-hydroxypropyl)-4-methoxyphenol?
5-fluoro-2-(2-hydroxypropyl)-4-methoxyphenol has a molecular weight of 200.21 g/mol, XLogP of 1.46, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-(2-hydroxypropyl)-4-methoxyphenol is sourced from PubChem (CID 117289277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).