1-cyclohexyl-4-(2-ethenoxyethyl)benzene

C16H22O — CID 177370560

IUPAC1-cyclohexyl-4-(2-ethenoxyethyl)benzene
SMILESC=COCCc1ccc(C2CCCCC2)cc1
InChIInChI=1S/C16H22O/c1-2-17-13-12-14-8-10-16(11-9-14)15-6-4-3-5-7-15/h2,8-11,15H,1,3-7,12-13H2
InChIKeyAHMCDSICITVQDK-UHFFFAOYSA-N
MW230.35 g/mol
LogP4.44
Rot. Bonds5

About 1-cyclohexyl-4-(2-ethenoxyethyl)benzene

1-cyclohexyl-4-(2-ethenoxyethyl)benzene (PubChem CID 177370560) has the molecular formula C16H22O and a molecular weight of 230.35 g/mol. Its IUPAC name is 1-cyclohexyl-4-(2-ethenoxyethyl)benzene.

Molecular Properties

Compound Name1-cyclohexyl-4-(2-ethenoxyethyl)benzene
PubChem CID177370560
Molecular FormulaC16H22O
Molecular Weight230.35 g/mol
Exact Mass230.17
IUPAC Name1-cyclohexyl-4-(2-ethenoxyethyl)benzene
SMILESC=COCCc1ccc(C2CCCCC2)cc1
InChIInChI=1S/C16H22O/c1-2-17-13-12-14-8-10-16(11-9-14)15-6-4-3-5-7-15/h2,8-11,15H,1,3-7,12-13H2
InChIKeyAHMCDSICITVQDK-UHFFFAOYSA-N
XLogP4.44
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

cyclohexylbenzene;ethenoxymethylbenzene
CID 161044898
1-(2-ethenoxyethyl)-4-[4-(2-ethenoxyethyl)phenyl]benzene
CID 22082114
1-cyclohexyl-4-ethenoxybenzene
CID 67464363
1-(2-ethenoxyethyl)-4-ethenylbenzene
CID 23031073
(4-cyclohexylphenyl)methanamine
CID 22246867
(4-ethenylphenyl)cyclooctane
CID 19849973
1-cyclohexyl-4-ethenylbenzene
CID 21225537
2,6-bis(2-ethenoxyethyl)naphthalene
CID 150795307
4-(4-cyclopentylphenyl)butan-1-amine
CID 117310056
(4-cyclohexylphenyl)-dideuteriomethanol
CID 162410552
4-(4-cyclohexylphenyl)butanoic acid
CID 3041568
1-cyclohexyl-4-[4-(4-cyclopentylphenyl)buta-1,3-dienyl]benzene
CID 173393354

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-4-(2-ethenoxyethyl)benzene?
The IUPAC name of 1-cyclohexyl-4-(2-ethenoxyethyl)benzene (CID 177370560) is 1-cyclohexyl-4-(2-ethenoxyethyl)benzene.
What is the SMILES notation for 1-cyclohexyl-4-(2-ethenoxyethyl)benzene?
The canonical SMILES for 1-cyclohexyl-4-(2-ethenoxyethyl)benzene is C=COCCc1ccc(C2CCCCC2)cc1.
What is the InChIKey of 1-cyclohexyl-4-(2-ethenoxyethyl)benzene?
The InChIKey is AHMCDSICITVQDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22O/c1-2-17-13-12-14-8-10-16(11-9-14)15-6-4-3-5-7-15/h2,8-11,15H,1,3-7,12-13H2.
What are the key properties of 1-cyclohexyl-4-(2-ethenoxyethyl)benzene?
1-cyclohexyl-4-(2-ethenoxyethyl)benzene has a molecular weight of 230.35 g/mol, XLogP of 4.44, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-4-(2-ethenoxyethyl)benzene is sourced from PubChem (CID 177370560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).