1-(6-chloro-3-fluoro-2-methoxyphenyl)ethanol

C9H10ClFO2 — CID 84672792

IUPAC1-(6-chloro-3-fluoro-2-methoxyphenyl)ethanol
SMILESCOc1c(F)ccc(Cl)c1C(C)O
InChIInChI=1S/C9H10ClFO2/c1-5(12)8-6(10)3-4-7(11)9(8)13-2/h3-5,12H,1-2H3
InChIKeyAWRXYFKOOGTHGN-UHFFFAOYSA-N
MW204.63 g/mol
LogP2.54
Rot. Bonds2

About 1-(6-chloro-3-fluoro-2-methoxyphenyl)ethanol

1-(6-chloro-3-fluoro-2-methoxyphenyl)ethanol (PubChem CID 84672792) has the molecular formula C9H10ClFO2 and a molecular weight of 204.63 g/mol. Its IUPAC name is 1-(6-chloro-3-fluoro-2-methoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(6-chloro-3-fluoro-2-methoxyphenyl)ethanol
PubChem CID84672792
Molecular FormulaC9H10ClFO2
Molecular Weight204.63 g/mol
Exact Mass204.04
IUPAC Name1-(6-chloro-3-fluoro-2-methoxyphenyl)ethanol
SMILESCOc1c(F)ccc(Cl)c1C(C)O
InChIInChI=1S/C9H10ClFO2/c1-5(12)8-6(10)3-4-7(11)9(8)13-2/h3-5,12H,1-2H3
InChIKeyAWRXYFKOOGTHGN-UHFFFAOYSA-N
XLogP2.54
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.63
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-Chloro-2-methylanisole
CID 76749
7-Chlorochroman-4-ol
CID 76851067
4 Chloro-2-methoxybenzyl alcohol
CID 3549393
Benzenemethanol, 5-chloro-3-ethyl-2-methoxy-
CID 42034
(1R)-1-(4-fluoro-2-methoxyphenyl)ethan-1-ol
CID 54594911
(6-Chloro-2-fluoro-3-methoxyphenyl)methanol
CID 3863467
(2-Chloro-4-methoxyphenyl)methanol
CID 14771756
(3-Fluoro-2-methoxyphenyl)methanol
CID 22505951
5-Chloro-2-(difluoromethoxy)benzenemethanol
CID 43141878
1-(5-Fluoro-2-methoxyphenyl)ethan-1-ol
CID 44891074
2-(4-Chloro-2-methoxyphenyl)ethan-1-ol
CID 54457787
(1S)-1-(4-fluoro-2-methoxyphenyl)ethan-1-ol
CID 54594634

Frequently Asked Questions

What is the IUPAC name of 1-(6-chloro-3-fluoro-2-methoxyphenyl)ethanol?
The IUPAC name of 1-(6-chloro-3-fluoro-2-methoxyphenyl)ethanol (CID 84672792) is 1-(6-chloro-3-fluoro-2-methoxyphenyl)ethanol.
What is the SMILES notation for 1-(6-chloro-3-fluoro-2-methoxyphenyl)ethanol?
The canonical SMILES for 1-(6-chloro-3-fluoro-2-methoxyphenyl)ethanol is COc1c(F)ccc(Cl)c1C(C)O.
What is the InChIKey of 1-(6-chloro-3-fluoro-2-methoxyphenyl)ethanol?
The InChIKey is AWRXYFKOOGTHGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10ClFO2/c1-5(12)8-6(10)3-4-7(11)9(8)13-2/h3-5,12H,1-2H3.
What are the key properties of 1-(6-chloro-3-fluoro-2-methoxyphenyl)ethanol?
1-(6-chloro-3-fluoro-2-methoxyphenyl)ethanol has a molecular weight of 204.63 g/mol, XLogP of 2.54, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-chloro-3-fluoro-2-methoxyphenyl)ethanol is sourced from PubChem (CID 84672792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).