2-fluoro-5-(3-hydroxypropyl)-4-methoxyphenol

C10H13FO3 — CID 117289231

IUPAC2-fluoro-5-(3-hydroxypropyl)-4-methoxyphenol
SMILESCOc1cc(F)c(O)cc1CCCO
InChIInChI=1S/C10H13FO3/c1-14-10-6-8(11)9(13)5-7(10)3-2-4-12/h5-6,12-13H,2-4H2,1H3
InChIKeyDUMOUWJQGRBFBX-UHFFFAOYSA-N
MW200.21 g/mol
LogP1.46
Rot. Bonds4

About 2-fluoro-5-(3-hydroxypropyl)-4-methoxyphenol

2-fluoro-5-(3-hydroxypropyl)-4-methoxyphenol (PubChem CID 117289231) has the molecular formula C10H13FO3 and a molecular weight of 200.21 g/mol. Its IUPAC name is 2-fluoro-5-(3-hydroxypropyl)-4-methoxyphenol.

Molecular Properties

Compound Name2-fluoro-5-(3-hydroxypropyl)-4-methoxyphenol
PubChem CID117289231
Molecular FormulaC10H13FO3
Molecular Weight200.21 g/mol
Exact Mass200.08
IUPAC Name2-fluoro-5-(3-hydroxypropyl)-4-methoxyphenol
SMILESCOc1cc(F)c(O)cc1CCCO
InChIInChI=1S/C10H13FO3/c1-14-10-6-8(11)9(13)5-7(10)3-2-4-12/h5-6,12-13H,2-4H2,1H3
InChIKeyDUMOUWJQGRBFBX-UHFFFAOYSA-N
XLogP1.46
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
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

3-(5-ethyl-4-fluoro-2-methoxyphenyl)propan-1-ol
CID 117303114
3-(4-fluoro-5-hydroxy-2-methoxyphenyl)propanoic acid
CID 117304993
2-(4-fluoro-5-hydroxy-2-methoxyphenyl)acetonitrile
CID 117278527
2,5-bis(2-aminoethyl)-4-methoxyphenol
CID 117274744
3-(6-methoxy-2,3-dihydro-1H-inden-5-yl)propan-1-ol
CID 117294969
5-chloro-4-(3-hydroxypropyl)-2-methoxyphenol
CID 117308657
5-fluoro-2-(3-hydroxypropyl)-3-methoxyphenol
CID 117289240
3-(2-chloro-5-fluoro-3-methoxyphenyl)propan-1-ol
CID 117311669
2-bromo-4-fluoro-3-(3-hydroxypropyl)-6-methoxyphenol
CID 117447283
4-hydroxy-5-(3-hydroxypropyl)-2-methoxybenzoic acid
CID 117325025
3-(4-ethyl-2-methoxy-5-methylsulfanylphenyl)propan-1-ol
CID 117353833
2-amino-3-(4-fluoro-5-hydroxy-2-methoxyphenyl)propanoic acid
CID 117329895

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5-(3-hydroxypropyl)-4-methoxyphenol?
The IUPAC name of 2-fluoro-5-(3-hydroxypropyl)-4-methoxyphenol (CID 117289231) is 2-fluoro-5-(3-hydroxypropyl)-4-methoxyphenol.
What is the SMILES notation for 2-fluoro-5-(3-hydroxypropyl)-4-methoxyphenol?
The canonical SMILES for 2-fluoro-5-(3-hydroxypropyl)-4-methoxyphenol is COc1cc(F)c(O)cc1CCCO.
What is the InChIKey of 2-fluoro-5-(3-hydroxypropyl)-4-methoxyphenol?
The InChIKey is DUMOUWJQGRBFBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FO3/c1-14-10-6-8(11)9(13)5-7(10)3-2-4-12/h5-6,12-13H,2-4H2,1H3.
What are the key properties of 2-fluoro-5-(3-hydroxypropyl)-4-methoxyphenol?
2-fluoro-5-(3-hydroxypropyl)-4-methoxyphenol has a molecular weight of 200.21 g/mol, XLogP of 1.46, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5-(3-hydroxypropyl)-4-methoxyphenol is sourced from PubChem (CID 117289231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).