6-chloro-2-fluoro-4-(1-hydroxycyclopropyl)-3-methoxyphenol

C10H10ClFO3 — CID 84795724

IUPAC6-chloro-2-fluoro-4-(1-hydroxycyclopropyl)-3-methoxyphenol
SMILESCOc1c(C2(O)CC2)cc(Cl)c(O)c1F
InChIInChI=1S/C10H10ClFO3/c1-15-9-5(10(14)2-3-10)4-6(11)8(13)7(9)12/h4,13-14H,2-3H2,1H3
InChIKeyGBBIRWLBSWJDSN-UHFFFAOYSA-N
MW232.64 g/mol
LogP2.17
Rot. Bonds2

About 6-chloro-2-fluoro-4-(1-hydroxycyclopropyl)-3-methoxyphenol

6-chloro-2-fluoro-4-(1-hydroxycyclopropyl)-3-methoxyphenol (PubChem CID 84795724) has the molecular formula C10H10ClFO3 and a molecular weight of 232.64 g/mol. Its IUPAC name is 6-chloro-2-fluoro-4-(1-hydroxycyclopropyl)-3-methoxyphenol.

Molecular Properties

Compound Name6-chloro-2-fluoro-4-(1-hydroxycyclopropyl)-3-methoxyphenol
PubChem CID84795724
Molecular FormulaC10H10ClFO3
Molecular Weight232.64 g/mol
Exact Mass232.03
IUPAC Name6-chloro-2-fluoro-4-(1-hydroxycyclopropyl)-3-methoxyphenol
SMILESCOc1c(C2(O)CC2)cc(Cl)c(O)c1F
InChIInChI=1S/C10H10ClFO3/c1-15-9-5(10(14)2-3-10)4-6(11)8(13)7(9)12/h4,13-14H,2-3H2,1H3
InChIKeyGBBIRWLBSWJDSN-UHFFFAOYSA-N
XLogP2.17
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.64
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-bromo-6-chloro-2-fluoro-3-methoxyphenol
CID 84805039
1-(5-tert-butyl-3-chloro-2-methoxyphenyl)cyclopropan-1-ol
CID 117390180
1-(7-fluoro-6-methoxy-1,3-benzodioxol-5-yl)cyclopropan-1-ol
CID 117324895
4-(1-hydroxycyclopropyl)-3-methoxy-2,6-dimethylphenol
CID 84780188
1-(3-chloro-2-methoxy-5-propan-2-ylphenyl)cyclopropan-1-ol
CID 117354237
5-chloro-4-fluoro-3-methoxybenzene-1,2-diol
CID 84664376
4-chloro-2-fluoro-6-(1-isocyanatocyclobutyl)-3-methoxyphenol
CID 117431843
6-chloro-3,4-difluoro-2-(1-hydroxycyclopropyl)phenol
CID 117314971
[1-(5-chloro-3,4-difluoro-2-methoxyphenyl)cyclopentyl]methanamine
CID 117441379
5-fluoro-2-(1-hydroxycyclopropyl)-4-methoxyphenol
CID 117287689
1-(5-fluoro-3,4-dimethoxy-2-methylphenyl)cyclopropan-1-ol
CID 117325333
4-chloro-3-fluoro-2-(1-hydroxycyclopropyl)-5-methoxyphenol
CID 84795728

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-fluoro-4-(1-hydroxycyclopropyl)-3-methoxyphenol?
The IUPAC name of 6-chloro-2-fluoro-4-(1-hydroxycyclopropyl)-3-methoxyphenol (CID 84795724) is 6-chloro-2-fluoro-4-(1-hydroxycyclopropyl)-3-methoxyphenol.
What is the SMILES notation for 6-chloro-2-fluoro-4-(1-hydroxycyclopropyl)-3-methoxyphenol?
The canonical SMILES for 6-chloro-2-fluoro-4-(1-hydroxycyclopropyl)-3-methoxyphenol is COc1c(C2(O)CC2)cc(Cl)c(O)c1F.
What is the InChIKey of 6-chloro-2-fluoro-4-(1-hydroxycyclopropyl)-3-methoxyphenol?
The InChIKey is GBBIRWLBSWJDSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClFO3/c1-15-9-5(10(14)2-3-10)4-6(11)8(13)7(9)12/h4,13-14H,2-3H2,1H3.
What are the key properties of 6-chloro-2-fluoro-4-(1-hydroxycyclopropyl)-3-methoxyphenol?
6-chloro-2-fluoro-4-(1-hydroxycyclopropyl)-3-methoxyphenol has a molecular weight of 232.64 g/mol, XLogP of 2.17, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-fluoro-4-(1-hydroxycyclopropyl)-3-methoxyphenol is sourced from PubChem (CID 84795724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).