2-(2-chloro-4-methoxyphenyl)ethanol

C9H11ClO2 — CID 66697098

IUPAC2-(2-chloro-4-methoxyphenyl)ethanol
SMILESCOc1ccc(CCO)c(Cl)c1
InChIInChI=1S/C9H11ClO2/c1-12-8-3-2-7(4-5-11)9(10)6-8/h2-3,6,11H,4-5H2,1H3
InChIKeyTVSNMTRXMHTHCR-UHFFFAOYSA-N
MW186.64 g/mol
LogP1.88
Rot. Bonds3

About 2-(2-chloro-4-methoxyphenyl)ethanol

2-(2-chloro-4-methoxyphenyl)ethanol (PubChem CID 66697098) has the molecular formula C9H11ClO2 and a molecular weight of 186.64 g/mol. Its IUPAC name is 2-(2-chloro-4-methoxyphenyl)ethanol.

Molecular Properties

Compound Name2-(2-chloro-4-methoxyphenyl)ethanol
PubChem CID66697098
Molecular FormulaC9H11ClO2
Molecular Weight186.64 g/mol
Exact Mass186.04
IUPAC Name2-(2-chloro-4-methoxyphenyl)ethanol
SMILESCOc1ccc(CCO)c(Cl)c1
InChIInChI=1S/C9H11ClO2/c1-12-8-3-2-7(4-5-11)9(10)6-8/h2-3,6,11H,4-5H2,1H3
InChIKeyTVSNMTRXMHTHCR-UHFFFAOYSA-N
XLogP1.88
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.64
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[2-(2-chloro-4-methoxyphenyl)ethylamino]butan-1-ol
CID 115217795
2-[(2-chloro-4-methoxyphenyl)methylamino]ethanol
CID 96658307
1-(3-bromopropyl)-2-chloro-4-methoxybenzene
CID 83942409
3-[(2-chloro-4-methoxyphenyl)methylamino]propan-1-ol
CID 115216842
(2-chloro-4-methoxyphenyl)methanamine
CID 22467642
2-(2-chloro-4-methoxyphenyl)ethylcarbamic acid
CID 115171143
2-(2-bromo-5-methoxyphenyl)ethanol
CID 10489678
1-amino-3-[2-(2-chloro-4-methoxyphenyl)ethyl]urea
CID 115192925
1-[2-(2-chloro-4-methoxyphenyl)ethylamino]propan-2-ol
CID 112513366
3-[(2-chloro-4-methoxyphenyl)methylsulfonyl]propan-1-ol
CID 111969329
N'-[2-(2-chloro-4-methoxyphenyl)ethyl]ethane-1,2-diamine
CID 115195439
4-(2-chloro-4-methoxyphenyl)-2,2-dimethylbutan-1-amine
CID 65305189

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-4-methoxyphenyl)ethanol?
The IUPAC name of 2-(2-chloro-4-methoxyphenyl)ethanol (CID 66697098) is 2-(2-chloro-4-methoxyphenyl)ethanol.
What is the SMILES notation for 2-(2-chloro-4-methoxyphenyl)ethanol?
The canonical SMILES for 2-(2-chloro-4-methoxyphenyl)ethanol is COc1ccc(CCO)c(Cl)c1.
What is the InChIKey of 2-(2-chloro-4-methoxyphenyl)ethanol?
The InChIKey is TVSNMTRXMHTHCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClO2/c1-12-8-3-2-7(4-5-11)9(10)6-8/h2-3,6,11H,4-5H2,1H3.
What are the key properties of 2-(2-chloro-4-methoxyphenyl)ethanol?
2-(2-chloro-4-methoxyphenyl)ethanol has a molecular weight of 186.64 g/mol, XLogP of 1.88, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-4-methoxyphenyl)ethanol is sourced from PubChem (CID 66697098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).