1-(2,6-dicyclohexylphenyl)anthracene

C32H34 — CID 141325859

IUPAC1-(2,6-dicyclohexylphenyl)anthracene
SMILESc1cc(C2CCCCC2)c(-c2cccc3cc4ccccc4cc23)c(C2CCCCC2)c1
InChIInChI=1S/C32H34/c1-3-11-23(12-4-1)28-18-10-19-29(24-13-5-2-6-14-24)32(28)30-20-9-17-27-21-25-15-7-8-16-26(25)22-31(27)30/h7-10,15-24H,1-6,11-14H2
InChIKeyIILNZWYHNZVJJH-UHFFFAOYSA-N
MW418.62 g/mol
LogP9.76
Rot. Bonds3

About 1-(2,6-dicyclohexylphenyl)anthracene

1-(2,6-dicyclohexylphenyl)anthracene (PubChem CID 141325859) has the molecular formula C32H34 and a molecular weight of 418.62 g/mol. Its IUPAC name is 1-(2,6-dicyclohexylphenyl)anthracene.

Molecular Properties

Compound Name1-(2,6-dicyclohexylphenyl)anthracene
PubChem CID141325859
Molecular FormulaC32H34
Molecular Weight418.62 g/mol
Exact Mass418.27
IUPAC Name1-(2,6-dicyclohexylphenyl)anthracene
SMILESc1cc(C2CCCCC2)c(-c2cccc3cc4ccccc4cc23)c(C2CCCCC2)c1
InChIInChI=1S/C32H34/c1-3-11-23(12-4-1)28-18-10-19-29(24-13-5-2-6-14-24)32(28)30-20-9-17-27-21-25-15-7-8-16-26(25)22-31(27)30/h7-10,15-24H,1-6,11-14H2
InChIKeyIILNZWYHNZVJJH-UHFFFAOYSA-N
XLogP9.76
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500418.62
LogP ≤ 59.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

1,2,4,5-tetrakis(2,6-dicyclohexylphenyl)benzene
CID 176589303
1,6-bis(2,6-dicyclopentylphenyl)pyrene
CID 149206447
9,10-di(anthracen-1-yl)anthracene
CID 58645093
1-tetracen-5-yltetracene
CID 91610936
9-(4-cyclohexyl-3-methylnaphthalen-2-yl)-9H-fluorene
CID 87492539
[1-(2-cyclohexylnaphthalen-1-yl)naphthalen-2-yl]phosphane
CID 155147383
4-(9,10-dicyclohexylanthracen-2-yl)benzo[a]anthracene
CID 156676969
1-(2,6-dimethylphenyl)pentacene
CID 163989342
9-[4-(2-cyclopentylnaphthalen-1-yl)phenyl]-10-naphthalen-2-ylanthracene
CID 59413180
1-(cyclononylmethyl)anthracene
CID 173272600
N-[2-(8-cyclohexylnaphthalen-1-yl)phenyl]-N-(2-naphthalen-1-ylphenyl)naphthalen-1-amine
CID 170303000
7-(2-cyclohexylnaphthalen-1-yl)-2,3-dihydroinden-1-one
CID 59052981

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dicyclohexylphenyl)anthracene?
The IUPAC name of 1-(2,6-dicyclohexylphenyl)anthracene (CID 141325859) is 1-(2,6-dicyclohexylphenyl)anthracene.
What is the SMILES notation for 1-(2,6-dicyclohexylphenyl)anthracene?
The canonical SMILES for 1-(2,6-dicyclohexylphenyl)anthracene is c1cc(C2CCCCC2)c(-c2cccc3cc4ccccc4cc23)c(C2CCCCC2)c1.
What is the InChIKey of 1-(2,6-dicyclohexylphenyl)anthracene?
The InChIKey is IILNZWYHNZVJJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H34/c1-3-11-23(12-4-1)28-18-10-19-29(24-13-5-2-6-14-24)32(28)30-20-9-17-27-21-25-15-7-8-16-26(25)22-31(27)30/h7-10,15-24H,1-6,11-14H2.
What are the key properties of 1-(2,6-dicyclohexylphenyl)anthracene?
1-(2,6-dicyclohexylphenyl)anthracene has a molecular weight of 418.62 g/mol, XLogP of 9.76, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dicyclohexylphenyl)anthracene is sourced from PubChem (CID 141325859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).