benzene;propan-2-ylcyclohexane

C15H24 — CID 163364158

IUPACbenzene;propan-2-ylcyclohexane
SMILESCC(C)C1CCCCC1.c1ccccc1
InChIInChI=1S/C9H18.C6H6/c1-8(2)9-6-4-3-5-7-9;1-2-4-6-5-3-1/h8-9H,3-7H2,1-2H3;1-6H
InChIKeyZVLGCDBBHBQQQO-UHFFFAOYSA-N
MW204.36 g/mol
LogP4.91
Rot. Bonds1

About benzene;propan-2-ylcyclohexane

benzene;propan-2-ylcyclohexane (PubChem CID 163364158) has the molecular formula C15H24 and a molecular weight of 204.36 g/mol. Its IUPAC name is benzene;propan-2-ylcyclohexane.

Molecular Properties

Compound Namebenzene;propan-2-ylcyclohexane
PubChem CID163364158
Molecular FormulaC15H24
Molecular Weight204.36 g/mol
Exact Mass204.19
IUPAC Namebenzene;propan-2-ylcyclohexane
SMILESCC(C)C1CCCCC1.c1ccccc1
InChIInChI=1S/C9H18.C6H6/c1-8(2)9-6-4-3-5-7-9;1-2-4-6-5-3-1/h8-9H,3-7H2,1-2H3;1-6H
InChIKeyZVLGCDBBHBQQQO-UHFFFAOYSA-N
XLogP4.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.36
LogP ≤ 54.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of benzene;propan-2-ylcyclohexane?
The IUPAC name of benzene;propan-2-ylcyclohexane (CID 163364158) is benzene;propan-2-ylcyclohexane.
What is the SMILES notation for benzene;propan-2-ylcyclohexane?
The canonical SMILES for benzene;propan-2-ylcyclohexane is CC(C)C1CCCCC1.c1ccccc1.
What is the InChIKey of benzene;propan-2-ylcyclohexane?
The InChIKey is ZVLGCDBBHBQQQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18.C6H6/c1-8(2)9-6-4-3-5-7-9;1-2-4-6-5-3-1/h8-9H,3-7H2,1-2H3;1-6H.
What are the key properties of benzene;propan-2-ylcyclohexane?
benzene;propan-2-ylcyclohexane has a molecular weight of 204.36 g/mol, XLogP of 4.91, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for benzene;propan-2-ylcyclohexane is sourced from PubChem (CID 163364158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).