CID 142053159

C24H33 — CID 142053159

IUPAC—
SMILESCC.CC(C)(C)c1ccc([C]2C=C2)cc1.CCc1cccc(C)c1
InChIInChI=1S/C13H15.C9H12.C2H6/c1-13(2,3)12-8-6-11(7-9-12)10-4-5-10;1-3-9-6-4-5-8(2)7-9;1-2/h4-9H,1-3H3;4-7H,3H2,1-2H3;1-2H3
InChIKeyFZJUCGXOXFOVIS-UHFFFAOYSA-N
MW321.53 g/mol
LogP7.06
Rot. Bonds2

About CID 142053159

CID 142053159 (PubChem CID 142053159) has the molecular formula C24H33 and a molecular weight of 321.53 g/mol.

Molecular Properties

Compound NameCID 142053159
PubChem CID142053159
Molecular FormulaC24H33
Molecular Weight321.53 g/mol
Exact Mass321.26
IUPAC Name—
SMILESCC.CC(C)(C)c1ccc([C]2C=C2)cc1.CCc1cccc(C)c1
InChIInChI=1S/C13H15.C9H12.C2H6/c1-13(2,3)12-8-6-11(7-9-12)10-4-5-10;1-3-9-6-4-5-8(2)7-9;1-2/h4-9H,1-3H3;4-7H,3H2,1-2H3;1-2H3
InChIKeyFZJUCGXOXFOVIS-UHFFFAOYSA-N
XLogP7.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500321.53
LogP ≤ 57.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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CID 142053160
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1-ethyl-4-(3-methylphenyl)benzene
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Frequently Asked Questions

What is the IUPAC name of CID 142053159?
The IUPAC name of CID 142053159 (CID 142053159) is not available.
What is the SMILES notation for CID 142053159?
The canonical SMILES for CID 142053159 is CC.CC(C)(C)c1ccc([C]2C=C2)cc1.CCc1cccc(C)c1.
What is the InChIKey of CID 142053159?
The InChIKey is FZJUCGXOXFOVIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15.C9H12.C2H6/c1-13(2,3)12-8-6-11(7-9-12)10-4-5-10;1-3-9-6-4-5-8(2)7-9;1-2/h4-9H,1-3H3;4-7H,3H2,1-2H3;1-2H3.
What are the key properties of CID 142053159?
CID 142053159 has a molecular weight of 321.53 g/mol, XLogP of 7.06, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 142053159 is sourced from PubChem (CID 142053159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).