1-chloro-2-[2-(2-chloroethoxy)ethoxy]cyclohexane

C10H18Cl2O2 — CID 3509767

IUPAC1-chloro-2-[2-(2-chloroethoxy)ethoxy]cyclohexane
SMILESClCCOCCOC1CCCCC1Cl
InChIInChI=1S/C10H18Cl2O2/c11-5-6-13-7-8-14-10-4-2-1-3-9(10)12/h9-10H,1-8H2
InChIKeyYSYUOOSVUURNBK-UHFFFAOYSA-N
MW241.16 g/mol
LogP2.81
Rot. Bonds6

About 1-chloro-2-[2-(2-chloroethoxy)ethoxy]cyclohexane

1-chloro-2-[2-(2-chloroethoxy)ethoxy]cyclohexane (PubChem CID 3509767) has the molecular formula C10H18Cl2O2 and a molecular weight of 241.16 g/mol. Its IUPAC name is 1-chloro-2-[2-(2-chloroethoxy)ethoxy]cyclohexane.

Molecular Properties

Compound Name1-chloro-2-[2-(2-chloroethoxy)ethoxy]cyclohexane
PubChem CID3509767
Molecular FormulaC10H18Cl2O2
Molecular Weight241.16 g/mol
Exact Mass240.07
IUPAC Name1-chloro-2-[2-(2-chloroethoxy)ethoxy]cyclohexane
SMILESClCCOCCOC1CCCCC1Cl
InChIInChI=1S/C10H18Cl2O2/c11-5-6-13-7-8-14-10-4-2-1-3-9(10)12/h9-10H,1-8H2
InChIKeyYSYUOOSVUURNBK-UHFFFAOYSA-N
XLogP2.81
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.16
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

cis-(1R,2S)-2-[2-[2-[(1R,2S)-2-hydroxycyclohexyl]oxyethoxy]ethoxy]cyclohexan-1-ol
CID 10891991
2-[2-[2-[2-[2-[2-[2-(2-chloroethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]oxane
CID 10646224
2-[3-[2-(2-chloroethoxy)ethoxy]oxan-2-yl]ethanol
CID 57083071
1-[2-[2-(2-chloroethoxy)ethoxy]ethoxy]-2-[2-[2-[2-(2-chloroethoxy)ethoxy]ethoxy]ethoxy]ethane
CID 13072765
1-[2-(2-chloroethoxy)ethoxy]-4-methylcyclohexane
CID 63665009
bis(2-chlorocyclohexyl) selenite
CID 21243547
1-bromo-2-(2-propoxyethoxy)cyclooctane
CID 114774148
1-bromo-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]cycloheptane
CID 104565568
2-(2-propoxyethoxy)cycloheptan-1-amine
CID 63685616
1-chloro-2-(2-chloroethoxy)ethane;dichloromethane
CID 174956973
1-(3-chloropropoxy)-2-methylcyclohexane
CID 24689088
2-[2-[2-(aminomethyl)cyclohexyl]oxyethoxy]ethanol
CID 106938416

Frequently Asked Questions

What is the IUPAC name of 1-chloro-2-[2-(2-chloroethoxy)ethoxy]cyclohexane?
The IUPAC name of 1-chloro-2-[2-(2-chloroethoxy)ethoxy]cyclohexane (CID 3509767) is 1-chloro-2-[2-(2-chloroethoxy)ethoxy]cyclohexane.
What is the SMILES notation for 1-chloro-2-[2-(2-chloroethoxy)ethoxy]cyclohexane?
The canonical SMILES for 1-chloro-2-[2-(2-chloroethoxy)ethoxy]cyclohexane is ClCCOCCOC1CCCCC1Cl.
What is the InChIKey of 1-chloro-2-[2-(2-chloroethoxy)ethoxy]cyclohexane?
The InChIKey is YSYUOOSVUURNBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18Cl2O2/c11-5-6-13-7-8-14-10-4-2-1-3-9(10)12/h9-10H,1-8H2.
What are the key properties of 1-chloro-2-[2-(2-chloroethoxy)ethoxy]cyclohexane?
1-chloro-2-[2-(2-chloroethoxy)ethoxy]cyclohexane has a molecular weight of 241.16 g/mol, XLogP of 2.81, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloro-2-[2-(2-chloroethoxy)ethoxy]cyclohexane is sourced from PubChem (CID 3509767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).