(6-ethoxycyclohexen-1-yl)benzene

C14H18O — CID 13170090

IUPAC(6-ethoxycyclohexen-1-yl)benzene
SMILESCCOC1CCCC=C1c1ccccc1
InChIInChI=1S/C14H18O/c1-2-15-14-11-7-6-10-13(14)12-8-4-3-5-9-12/h3-5,8-10,14H,2,6-7,11H2,1H3
InChIKeyDDQAQMWIFMXPKE-UHFFFAOYSA-N
MW202.30 g/mol
LogP3.66
Rot. Bonds3

About (6-ethoxycyclohexen-1-yl)benzene

(6-ethoxycyclohexen-1-yl)benzene (PubChem CID 13170090) has the molecular formula C14H18O and a molecular weight of 202.30 g/mol. Its IUPAC name is (6-ethoxycyclohexen-1-yl)benzene.

Molecular Properties

Compound Name(6-ethoxycyclohexen-1-yl)benzene
PubChem CID13170090
Molecular FormulaC14H18O
Molecular Weight202.30 g/mol
Exact Mass202.14
IUPAC Name(6-ethoxycyclohexen-1-yl)benzene
SMILESCCOC1CCCC=C1c1ccccc1
InChIInChI=1S/C14H18O/c1-2-15-14-11-7-6-10-13(14)12-8-4-3-5-9-12/h3-5,8-10,14H,2,6-7,11H2,1H3
InChIKeyDDQAQMWIFMXPKE-UHFFFAOYSA-N
XLogP3.66
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (6-ethoxycyclohexen-1-yl)benzene?
The IUPAC name of (6-ethoxycyclohexen-1-yl)benzene (CID 13170090) is (6-ethoxycyclohexen-1-yl)benzene.
What is the SMILES notation for (6-ethoxycyclohexen-1-yl)benzene?
The canonical SMILES for (6-ethoxycyclohexen-1-yl)benzene is CCOC1CCCC=C1c1ccccc1.
What is the InChIKey of (6-ethoxycyclohexen-1-yl)benzene?
The InChIKey is DDQAQMWIFMXPKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18O/c1-2-15-14-11-7-6-10-13(14)12-8-4-3-5-9-12/h3-5,8-10,14H,2,6-7,11H2,1H3.
What are the key properties of (6-ethoxycyclohexen-1-yl)benzene?
(6-ethoxycyclohexen-1-yl)benzene has a molecular weight of 202.30 g/mol, XLogP of 3.66, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6-ethoxycyclohexen-1-yl)benzene is sourced from PubChem (CID 13170090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).