2-[2-(2-chloro-5-methylphenoxy)ethoxy]ethanol

C11H15ClO3 — CID 61075702

IUPAC2-[2-(2-chloro-5-methylphenoxy)ethoxy]ethanol
SMILESCc1ccc(Cl)c(OCCOCCO)c1
InChIInChI=1S/C11H15ClO3/c1-9-2-3-10(12)11(8-9)15-7-6-14-5-4-13/h2-3,8,13H,4-7H2,1H3
InChIKeyAPJMDWPWRDNNPH-UHFFFAOYSA-N
MW230.69 g/mol
LogP2.04
Rot. Bonds6

About 2-[2-(2-chloro-5-methylphenoxy)ethoxy]ethanol

2-[2-(2-chloro-5-methylphenoxy)ethoxy]ethanol (PubChem CID 61075702) has the molecular formula C11H15ClO3 and a molecular weight of 230.69 g/mol. Its IUPAC name is 2-[2-(2-chloro-5-methylphenoxy)ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-(2-chloro-5-methylphenoxy)ethoxy]ethanol
PubChem CID61075702
Molecular FormulaC11H15ClO3
Molecular Weight230.69 g/mol
Exact Mass230.07
IUPAC Name2-[2-(2-chloro-5-methylphenoxy)ethoxy]ethanol
SMILESCc1ccc(Cl)c(OCCOCCO)c1
InChIInChI=1S/C11H15ClO3/c1-9-2-3-10(12)11(8-9)15-7-6-14-5-4-13/h2-3,8,13H,4-7H2,1H3
InChIKeyAPJMDWPWRDNNPH-UHFFFAOYSA-N
XLogP2.04
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.69
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-chloro-2-[2-[2-(2-methoxy-4-methylphenoxy)ethoxy]ethoxy]-4-methylbenzene
CID 2285628
1-chloro-2-[2-[2-(4-ethoxyphenoxy)ethoxy]ethoxy]-4-methylbenzene
CID 2284223
2-[2-[2-[(1R)-1-aminoethyl]-5-methylphenoxy]ethoxy]ethanol
CID 63650862
2-[2-[2-(1-aminoethyl)-5-methylphenoxy]ethoxy]ethanol
CID 63639091
N'-[2-[2-(2-chloro-5-methylphenoxy)ethoxy]ethyl]ethane-1,2-diamine
CID 2276700
2-[2-(2-chloro-5-methylphenoxy)ethoxy]-5-methylaniline
CID 39399728
2-[3-(2-chloro-5-methylphenoxy)propoxy]-N-methylethanamine
CID 82353992
2-[2-(2,3,5-trimethylphenoxy)ethoxy]ethanol
CID 61076408
(2R,6R)-4-[2-[2-(2-chloro-5-methylphenoxy)ethoxy]ethyl]-2,6-dimethylmorpholin-4-ium
CID 2181771
1-chloro-2-[3-(2-methoxy-4-methylphenoxy)propoxy]-4-methylbenzene
CID 2899624
7-(2-chloro-5-methylphenoxy)heptanoic acid
CID 39369862
2-chloro-4-methyl-1-[2-(2,2,2-trifluoroethoxy)ethoxy]benzene
CID 121390824

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-chloro-5-methylphenoxy)ethoxy]ethanol?
The IUPAC name of 2-[2-(2-chloro-5-methylphenoxy)ethoxy]ethanol (CID 61075702) is 2-[2-(2-chloro-5-methylphenoxy)ethoxy]ethanol.
What is the SMILES notation for 2-[2-(2-chloro-5-methylphenoxy)ethoxy]ethanol?
The canonical SMILES for 2-[2-(2-chloro-5-methylphenoxy)ethoxy]ethanol is Cc1ccc(Cl)c(OCCOCCO)c1.
What is the InChIKey of 2-[2-(2-chloro-5-methylphenoxy)ethoxy]ethanol?
The InChIKey is APJMDWPWRDNNPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClO3/c1-9-2-3-10(12)11(8-9)15-7-6-14-5-4-13/h2-3,8,13H,4-7H2,1H3.
What are the key properties of 2-[2-(2-chloro-5-methylphenoxy)ethoxy]ethanol?
2-[2-(2-chloro-5-methylphenoxy)ethoxy]ethanol has a molecular weight of 230.69 g/mol, XLogP of 2.04, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-chloro-5-methylphenoxy)ethoxy]ethanol is sourced from PubChem (CID 61075702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).