1-(5-chloro-2-methoxyphenyl)ethanol

C9H11ClO2 — CID 58046356

IUPAC1-(5-chloro-2-methoxyphenyl)ethanol
SMILESCOc1ccc(Cl)cc1C(C)O
InChIInChI=1S/C9H11ClO2/c1-6(11)8-5-7(10)3-4-9(8)12-2/h3-6,11H,1-2H3
InChIKeySZSSGZBQJZZVER-UHFFFAOYSA-N
MW186.64 g/mol
LogP2.40
Rot. Bonds2

About 1-(5-chloro-2-methoxyphenyl)ethanol

1-(5-chloro-2-methoxyphenyl)ethanol (PubChem CID 58046356) has the molecular formula C9H11ClO2 and a molecular weight of 186.64 g/mol. Its IUPAC name is 1-(5-chloro-2-methoxyphenyl)ethanol.

Molecular Properties

Compound Name1-(5-chloro-2-methoxyphenyl)ethanol
PubChem CID58046356
Molecular FormulaC9H11ClO2
Molecular Weight186.64 g/mol
Exact Mass186.04
IUPAC Name1-(5-chloro-2-methoxyphenyl)ethanol
SMILESCOc1ccc(Cl)cc1C(C)O
InChIInChI=1S/C9H11ClO2/c1-6(11)8-5-7(10)3-4-9(8)12-2/h3-6,11H,1-2H3
InChIKeySZSSGZBQJZZVER-UHFFFAOYSA-N
XLogP2.40
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.64
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Butanoic acid, 4-(4-chloro-2-methylphenoxy)-
CID 7207
Cloxyfonac
CID 22883
2-Methoxybenzyl alcohol
CID 69154
4-Chloro-2-methylanisole
CID 76748
5-Chlorosalicyl alcohol
CID 79238
3-(2-Chloro-6-methylphenoxy)-1,2-propanediol
CID 98050
Trametol
CID 10353281
Benzenemethanol, alpha-ethyl-2-methoxy-
CID 24018
4-Chloro-2-Ethylphenol
CID 29357
2-Methoxy-alpha-methylbenzyl alcohol
CID 114538
(1R)-1-(2-methoxyphenyl)ethan-1-ol
CID 643317
(1S)-1-(2-methoxyphenyl)ethan-1-ol
CID 7058089

Frequently Asked Questions

What is the IUPAC name of 1-(5-chloro-2-methoxyphenyl)ethanol?
The IUPAC name of 1-(5-chloro-2-methoxyphenyl)ethanol (CID 58046356) is 1-(5-chloro-2-methoxyphenyl)ethanol.
What is the SMILES notation for 1-(5-chloro-2-methoxyphenyl)ethanol?
The canonical SMILES for 1-(5-chloro-2-methoxyphenyl)ethanol is COc1ccc(Cl)cc1C(C)O.
What is the InChIKey of 1-(5-chloro-2-methoxyphenyl)ethanol?
The InChIKey is SZSSGZBQJZZVER-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClO2/c1-6(11)8-5-7(10)3-4-9(8)12-2/h3-6,11H,1-2H3.
What are the key properties of 1-(5-chloro-2-methoxyphenyl)ethanol?
1-(5-chloro-2-methoxyphenyl)ethanol has a molecular weight of 186.64 g/mol, XLogP of 2.40, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chloro-2-methoxyphenyl)ethanol is sourced from PubChem (CID 58046356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).