1-(2-cyclohexylphenyl)-1,2-dihydroacenaphthylene

C24H24 — CID 174425493

IUPAC1-(2-cyclohexylphenyl)-1,2-dihydroacenaphthylene
SMILESc1ccc(C2Cc3cccc4cccc2c34)c(C2CCCCC2)c1
InChIInChI=1S/C24H24/c1-2-8-17(9-3-1)20-13-4-5-14-21(20)23-16-19-12-6-10-18-11-7-15-22(23)24(18)19/h4-7,10-15,17,23H,1-3,8-9,16H2
InChIKeyLDQZAWZDYJPFPL-UHFFFAOYSA-N
MW312.46 g/mol
LogP6.58
Rot. Bonds2

About 1-(2-cyclohexylphenyl)-1,2-dihydroacenaphthylene

1-(2-cyclohexylphenyl)-1,2-dihydroacenaphthylene (PubChem CID 174425493) has the molecular formula C24H24 and a molecular weight of 312.46 g/mol. Its IUPAC name is 1-(2-cyclohexylphenyl)-1,2-dihydroacenaphthylene.

Molecular Properties

Compound Name1-(2-cyclohexylphenyl)-1,2-dihydroacenaphthylene
PubChem CID174425493
Molecular FormulaC24H24
Molecular Weight312.46 g/mol
Exact Mass312.19
IUPAC Name1-(2-cyclohexylphenyl)-1,2-dihydroacenaphthylene
SMILESc1ccc(C2Cc3cccc4cccc2c34)c(C2CCCCC2)c1
InChIInChI=1S/C24H24/c1-2-8-17(9-3-1)20-13-4-5-14-21(20)23-16-19-12-6-10-18-11-7-15-22(23)24(18)19/h4-7,10-15,17,23H,1-3,8-9,16H2
InChIKeyLDQZAWZDYJPFPL-UHFFFAOYSA-N
XLogP6.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500312.46
LogP ≤ 56.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclohexylphenyl)-1,2-dihydroacenaphthylene?
The IUPAC name of 1-(2-cyclohexylphenyl)-1,2-dihydroacenaphthylene (CID 174425493) is 1-(2-cyclohexylphenyl)-1,2-dihydroacenaphthylene.
What is the SMILES notation for 1-(2-cyclohexylphenyl)-1,2-dihydroacenaphthylene?
The canonical SMILES for 1-(2-cyclohexylphenyl)-1,2-dihydroacenaphthylene is c1ccc(C2Cc3cccc4cccc2c34)c(C2CCCCC2)c1.
What is the InChIKey of 1-(2-cyclohexylphenyl)-1,2-dihydroacenaphthylene?
The InChIKey is LDQZAWZDYJPFPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24/c1-2-8-17(9-3-1)20-13-4-5-14-21(20)23-16-19-12-6-10-18-11-7-15-22(23)24(18)19/h4-7,10-15,17,23H,1-3,8-9,16H2.
What are the key properties of 1-(2-cyclohexylphenyl)-1,2-dihydroacenaphthylene?
1-(2-cyclohexylphenyl)-1,2-dihydroacenaphthylene has a molecular weight of 312.46 g/mol, XLogP of 6.58, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclohexylphenyl)-1,2-dihydroacenaphthylene is sourced from PubChem (CID 174425493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).