tris(1-propan-2-ylcyclopenta-1,3-diene);terbium

C24H36Tb — CID 174728130

IUPACtris(1-propan-2-ylcyclopenta-1,3-diene);terbium
SMILESCC(C)C1=CC=CC1.CC(C)C1=CC=CC1.CC(C)C1=CC=CC1.[Tb]
InChIInChI=1S/3C8H12.Tb/c3*1-7(2)8-5-3-4-6-8;/h3*3-5,7H,6H2,1-2H3;
InChIKeyRJKIJYCLVBSLMZ-UHFFFAOYSA-N
MW483.48 g/mol
LogP7.59
Rot. Bonds3

About tris(1-propan-2-ylcyclopenta-1,3-diene);terbium

tris(1-propan-2-ylcyclopenta-1,3-diene);terbium (PubChem CID 174728130) has the molecular formula C24H36Tb and a molecular weight of 483.48 g/mol. Its IUPAC name is tris(1-propan-2-ylcyclopenta-1,3-diene);terbium.

Molecular Properties

Compound Nametris(1-propan-2-ylcyclopenta-1,3-diene);terbium
PubChem CID174728130
Molecular FormulaC24H36Tb
Molecular Weight483.48 g/mol
Exact Mass483.21
IUPAC Nametris(1-propan-2-ylcyclopenta-1,3-diene);terbium
SMILESCC(C)C1=CC=CC1.CC(C)C1=CC=CC1.CC(C)C1=CC=CC1.[Tb]
InChIInChI=1S/3C8H12.Tb/c3*1-7(2)8-5-3-4-6-8;/h3*3-5,7H,6H2,1-2H3;
InChIKeyRJKIJYCLVBSLMZ-UHFFFAOYSA-N
XLogP7.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500483.48
LogP ≤ 57.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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CID 173014987
2-cyclopenta-1,3-dien-1-yl-N,N-dimethylpropan-1-amine
CID 45088275
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CID 11116496
1-cyclohepta-1,3,5-trien-1-ylethanethiol
CID 142981242
2,2-di(cyclopenta-1,3-dien-1-yl)ethanol
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Frequently Asked Questions

What is the IUPAC name of tris(1-propan-2-ylcyclopenta-1,3-diene);terbium?
The IUPAC name of tris(1-propan-2-ylcyclopenta-1,3-diene);terbium (CID 174728130) is tris(1-propan-2-ylcyclopenta-1,3-diene);terbium.
What is the SMILES notation for tris(1-propan-2-ylcyclopenta-1,3-diene);terbium?
The canonical SMILES for tris(1-propan-2-ylcyclopenta-1,3-diene);terbium is CC(C)C1=CC=CC1.CC(C)C1=CC=CC1.CC(C)C1=CC=CC1.[Tb].
What is the InChIKey of tris(1-propan-2-ylcyclopenta-1,3-diene);terbium?
The InChIKey is RJKIJYCLVBSLMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/3C8H12.Tb/c3*1-7(2)8-5-3-4-6-8;/h3*3-5,7H,6H2,1-2H3;.
What are the key properties of tris(1-propan-2-ylcyclopenta-1,3-diene);terbium?
tris(1-propan-2-ylcyclopenta-1,3-diene);terbium has a molecular weight of 483.48 g/mol, XLogP of 7.59, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tris(1-propan-2-ylcyclopenta-1,3-diene);terbium is sourced from PubChem (CID 174728130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).