Cyclohexane, (1-ethoxy-1-methylethyl)-

C11H22O — CID 175128

IUPAC2-ethoxypropan-2-ylcyclohexane
SMILESCCOC(C)(C)C1CCCCC1
InChIInChI=1S/C11H22O/c1-4-12-11(2,3)10-8-6-5-7-9-10/h10H,4-9H2,1-3H3
InChIKeyMQFSZQIPCBEAGQ-UHFFFAOYSA-N
MW170.29 g/mol
LogP3.40
Rot. Bonds3

About Cyclohexane, (1-ethoxy-1-methylethyl)-

Cyclohexane, (1-ethoxy-1-methylethyl)- (PubChem CID 175128) has the molecular formula C11H22O and a molecular weight of 170.29 g/mol. Its IUPAC name is 2-ethoxypropan-2-ylcyclohexane.

Molecular Properties

Compound NameCyclohexane, (1-ethoxy-1-methylethyl)-
PubChem CID175128
Molecular FormulaC11H22O
Molecular Weight170.29 g/mol
Exact Mass170.17
IUPAC Name2-ethoxypropan-2-ylcyclohexane
SMILESCCOC(C)(C)C1CCCCC1
InChIInChI=1S/C11H22O/c1-4-12-11(2,3)10-8-6-5-7-9-10/h10H,4-9H2,1-3H3
InChIKeyMQFSZQIPCBEAGQ-UHFFFAOYSA-N
XLogP3.40
TPSA9.20 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity123

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.29
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of Cyclohexane, (1-ethoxy-1-methylethyl)-?
The IUPAC name of Cyclohexane, (1-ethoxy-1-methylethyl)- (CID 175128) is 2-ethoxypropan-2-ylcyclohexane.
What is the SMILES notation for Cyclohexane, (1-ethoxy-1-methylethyl)-?
The canonical SMILES for Cyclohexane, (1-ethoxy-1-methylethyl)- is CCOC(C)(C)C1CCCCC1.
What is the InChIKey of Cyclohexane, (1-ethoxy-1-methylethyl)-?
The InChIKey is MQFSZQIPCBEAGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O/c1-4-12-11(2,3)10-8-6-5-7-9-10/h10H,4-9H2,1-3H3.
What are the key properties of Cyclohexane, (1-ethoxy-1-methylethyl)-?
Cyclohexane, (1-ethoxy-1-methylethyl)- has a molecular weight of 170.29 g/mol, XLogP of 3.40, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for Cyclohexane, (1-ethoxy-1-methylethyl)- is sourced from PubChem (CID 175128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).