(5-propan-2-ylcyclohexa-2,4-dien-1-yl)benzene

C15H18 — CID 175695810

IUPAC(5-propan-2-ylcyclohexa-2,4-dien-1-yl)benzene
SMILESCC(C)C1=CC=CC(c2ccccc2)C1
InChIInChI=1S/C15H18/c1-12(2)14-9-6-10-15(11-14)13-7-4-3-5-8-13/h3-10,12,15H,11H2,1-2H3
InChIKeyJUOAAFLMRDZRCF-UHFFFAOYSA-N
MW198.31 g/mol
LogP4.31
Rot. Bonds2

About (5-propan-2-ylcyclohexa-2,4-dien-1-yl)benzene

(5-propan-2-ylcyclohexa-2,4-dien-1-yl)benzene (PubChem CID 175695810) has the molecular formula C15H18 and a molecular weight of 198.31 g/mol. Its IUPAC name is (5-propan-2-ylcyclohexa-2,4-dien-1-yl)benzene.

Molecular Properties

Compound Name(5-propan-2-ylcyclohexa-2,4-dien-1-yl)benzene
PubChem CID175695810
Molecular FormulaC15H18
Molecular Weight198.31 g/mol
Exact Mass198.14
IUPAC Name(5-propan-2-ylcyclohexa-2,4-dien-1-yl)benzene
SMILESCC(C)C1=CC=CC(c2ccccc2)C1
InChIInChI=1S/C15H18/c1-12(2)14-9-6-10-15(11-14)13-7-4-3-5-8-13/h3-10,12,15H,11H2,1-2H3
InChIKeyJUOAAFLMRDZRCF-UHFFFAOYSA-N
XLogP4.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 54.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (5-propan-2-ylcyclohexa-2,4-dien-1-yl)benzene?
The IUPAC name of (5-propan-2-ylcyclohexa-2,4-dien-1-yl)benzene (CID 175695810) is (5-propan-2-ylcyclohexa-2,4-dien-1-yl)benzene.
What is the SMILES notation for (5-propan-2-ylcyclohexa-2,4-dien-1-yl)benzene?
The canonical SMILES for (5-propan-2-ylcyclohexa-2,4-dien-1-yl)benzene is CC(C)C1=CC=CC(c2ccccc2)C1.
What is the InChIKey of (5-propan-2-ylcyclohexa-2,4-dien-1-yl)benzene?
The InChIKey is JUOAAFLMRDZRCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18/c1-12(2)14-9-6-10-15(11-14)13-7-4-3-5-8-13/h3-10,12,15H,11H2,1-2H3.
What are the key properties of (5-propan-2-ylcyclohexa-2,4-dien-1-yl)benzene?
(5-propan-2-ylcyclohexa-2,4-dien-1-yl)benzene has a molecular weight of 198.31 g/mol, XLogP of 4.31, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (5-propan-2-ylcyclohexa-2,4-dien-1-yl)benzene is sourced from PubChem (CID 175695810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).