2-(2,4-dichlorophenoxy)ethanol

C8H8Cl2O2 — CID 8444

IUPAC2-(2,4-dichlorophenoxy)ethanol
SMILESOCCOc1ccc(Cl)cc1Cl
InChIInChI=1S/C8H8Cl2O2/c9-6-1-2-8(7(10)5-6)12-4-3-11/h1-2,5,11H,3-4H2
InChIKeyPCCMNBRZMKANQD-UHFFFAOYSA-N
MW207.06 g/mol
LogP2.36
Rot. Bonds3

About 2-(2,4-dichlorophenoxy)ethanol

2-(2,4-dichlorophenoxy)ethanol (PubChem CID 8444) has the molecular formula C8H8Cl2O2 and a molecular weight of 207.06 g/mol. Its IUPAC name is 2-(2,4-dichlorophenoxy)ethanol.

Molecular Properties

Compound Name2-(2,4-dichlorophenoxy)ethanol
PubChem CID8444
Molecular FormulaC8H8Cl2O2
Molecular Weight207.06 g/mol
Exact Mass205.99
IUPAC Name2-(2,4-dichlorophenoxy)ethanol
SMILESOCCOc1ccc(Cl)cc1Cl
InChIInChI=1S/C8H8Cl2O2/c9-6-1-2-8(7(10)5-6)12-4-3-11/h1-2,5,11H,3-4H2
InChIKeyPCCMNBRZMKANQD-UHFFFAOYSA-N
XLogP2.36
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.06
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Triclosan
CID 5564
(2,4-Dichlorophenoxy)Acetic Acid
CID 1486
2,4-D n-butyl ester
CID 7206
2,4-D-sodium
CID 23676704
4-(2,4-Dichlorophenoxy)butyric acid
CID 1489
Dichlorprop
CID 8427
Chlorphenesin
CID 7697
2,4-D Isopropyl Ester
CID 7173
Butoxyethanol ester of 2,4-dichlorophenoxyacetic acid
CID 16002
2-(4-Chlorophenoxy)ethanol
CID 15907
Dichlorprop-P
CID 119435
2,4-D, butoxypropyl ester
CID 15997

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenoxy)ethanol?
The IUPAC name of 2-(2,4-dichlorophenoxy)ethanol (CID 8444) is 2-(2,4-dichlorophenoxy)ethanol.
What is the SMILES notation for 2-(2,4-dichlorophenoxy)ethanol?
The canonical SMILES for 2-(2,4-dichlorophenoxy)ethanol is OCCOc1ccc(Cl)cc1Cl.
What is the InChIKey of 2-(2,4-dichlorophenoxy)ethanol?
The InChIKey is PCCMNBRZMKANQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8Cl2O2/c9-6-1-2-8(7(10)5-6)12-4-3-11/h1-2,5,11H,3-4H2.
What are the key properties of 2-(2,4-dichlorophenoxy)ethanol?
2-(2,4-dichlorophenoxy)ethanol has a molecular weight of 207.06 g/mol, XLogP of 2.36, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenoxy)ethanol is sourced from PubChem (CID 8444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).