2-(2,4-dichlorophenyl)-1-(1-ethoxycyclohexyl)ethanol

C16H22Cl2O2 — CID 116753637

IUPAC2-(2,4-dichlorophenyl)-1-(1-ethoxycyclohexyl)ethanol
SMILESCCOC1(C(O)Cc2ccc(Cl)cc2Cl)CCCCC1
InChIInChI=1S/C16H22Cl2O2/c1-2-20-16(8-4-3-5-9-16)15(19)10-12-6-7-13(17)11-14(12)18/h6-7,11,15,19H,2-5,8-10H2,1H3
InChIKeyUUONRMPFJUJWOL-UHFFFAOYSA-N
MW317.26 g/mol
LogP4.64
Rot. Bonds5

About 2-(2,4-dichlorophenyl)-1-(1-ethoxycyclohexyl)ethanol

2-(2,4-dichlorophenyl)-1-(1-ethoxycyclohexyl)ethanol (PubChem CID 116753637) has the molecular formula C16H22Cl2O2 and a molecular weight of 317.26 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-1-(1-ethoxycyclohexyl)ethanol.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-1-(1-ethoxycyclohexyl)ethanol
PubChem CID116753637
Molecular FormulaC16H22Cl2O2
Molecular Weight317.26 g/mol
Exact Mass316.10
IUPAC Name2-(2,4-dichlorophenyl)-1-(1-ethoxycyclohexyl)ethanol
SMILESCCOC1(C(O)Cc2ccc(Cl)cc2Cl)CCCCC1
InChIInChI=1S/C16H22Cl2O2/c1-2-20-16(8-4-3-5-9-16)15(19)10-12-6-7-13(17)11-14(12)18/h6-7,11,15,19H,2-5,8-10H2,1H3
InChIKeyUUONRMPFJUJWOL-UHFFFAOYSA-N
XLogP4.64
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.26
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-chlorophenyl)-1-(1-ethoxycyclohexyl)ethanol
CID 116753633
2-(2-chloro-5-fluorophenyl)-1-(1-ethoxycyclohexyl)ethanol
CID 102618286
2-(2,3-dichlorophenyl)-1-(1-ethoxycyclohexyl)ethanol
CID 107308277
2-(2-chloro-4-methylphenyl)-1-(1-ethoxycycloheptyl)ethanamine
CID 106868865
(4-chloro-2-fluorophenyl)-(1-ethoxycyclohexyl)methanol
CID 116753618
2-(2,4-dichlorophenyl)-1-(1-methoxycycloheptyl)-N-methylethanamine
CID 116770042
2-(4-bromo-2-chlorophenyl)-1-(1-ethoxycyclopentyl)ethanamine
CID 116761557
2-(2-bromo-3-fluorophenyl)-1-(1-ethoxycycloheptyl)ethanol
CID 116756150
[2-(2,4-dichlorophenyl)-1-(4-ethoxyoxan-4-yl)ethyl]hydrazine
CID 105276920
1-(1-ethoxycyclohexyl)-2-(2,4,6-trimethylphenyl)ethanol
CID 116753691
2-(2-chlorophenyl)-1-(1-ethoxycycloheptyl)ethanamine
CID 116770609
2-(2-bromo-5-methoxyphenyl)-1-(1-ethoxycyclopentyl)ethanol
CID 116753002

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-1-(1-ethoxycyclohexyl)ethanol?
The IUPAC name of 2-(2,4-dichlorophenyl)-1-(1-ethoxycyclohexyl)ethanol (CID 116753637) is 2-(2,4-dichlorophenyl)-1-(1-ethoxycyclohexyl)ethanol.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-1-(1-ethoxycyclohexyl)ethanol?
The canonical SMILES for 2-(2,4-dichlorophenyl)-1-(1-ethoxycyclohexyl)ethanol is CCOC1(C(O)Cc2ccc(Cl)cc2Cl)CCCCC1.
What is the InChIKey of 2-(2,4-dichlorophenyl)-1-(1-ethoxycyclohexyl)ethanol?
The InChIKey is UUONRMPFJUJWOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22Cl2O2/c1-2-20-16(8-4-3-5-9-16)15(19)10-12-6-7-13(17)11-14(12)18/h6-7,11,15,19H,2-5,8-10H2,1H3.
What are the key properties of 2-(2,4-dichlorophenyl)-1-(1-ethoxycyclohexyl)ethanol?
2-(2,4-dichlorophenyl)-1-(1-ethoxycyclohexyl)ethanol has a molecular weight of 317.26 g/mol, XLogP of 4.64, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-1-(1-ethoxycyclohexyl)ethanol is sourced from PubChem (CID 116753637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).