terbium;bis(1,3,5-tritert-butylbenzene)

C36H60Tb — CID 134902614

IUPACterbium;bis(1,3,5-tritert-butylbenzene)
SMILESCC(C)(C)c1cc(C(C)(C)C)cc(C(C)(C)C)c1.CC(C)(C)c1cc(C(C)(C)C)cc(C(C)(C)C)c1.[Tb]
InChIInChI=1S/2C18H30.Tb/c2*1-16(2,3)13-10-14(17(4,5)6)12-15(11-13)18(7,8)9;/h2*10-12H,1-9H3;
InChIKeyWKIHYYPJHGIHOA-UHFFFAOYSA-N
MW651.80 g/mol
LogP11.16
Rot. Bonds

About terbium;bis(1,3,5-tritert-butylbenzene)

terbium;bis(1,3,5-tritert-butylbenzene) (PubChem CID 134902614) has the molecular formula C36H60Tb and a molecular weight of 651.80 g/mol. Its IUPAC name is terbium;bis(1,3,5-tritert-butylbenzene).

Molecular Properties

Compound Nameterbium;bis(1,3,5-tritert-butylbenzene)
PubChem CID134902614
Molecular FormulaC36H60Tb
Molecular Weight651.80 g/mol
Exact Mass651.39
IUPAC Nameterbium;bis(1,3,5-tritert-butylbenzene)
SMILESCC(C)(C)c1cc(C(C)(C)C)cc(C(C)(C)C)c1.CC(C)(C)c1cc(C(C)(C)C)cc(C(C)(C)C)c1.[Tb]
InChIInChI=1S/2C18H30.Tb/c2*1-16(2,3)13-10-14(17(4,5)6)12-15(11-13)18(7,8)9;/h2*10-12H,1-9H3;
InChIKeyWKIHYYPJHGIHOA-UHFFFAOYSA-N
XLogP11.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500651.80
LogP ≤ 511.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

ethane;methane;1,3,5-tritert-butylbenzene
CID 144683024
bis(3,5-ditert-butylphenyl)phosphane
CID 4191558
1,3-ditert-butyl-5-[2-(3,5-ditert-butylphenyl)ethenyl]benzene
CID 4625492
1,3-ditert-butyl-5-(2-methylbutan-2-yl)benzene
CID 123729518
1-tert-butyl-3,5-bis(2-methoxypropan-2-yl)benzene
CID 141239687
1,3-ditert-butyl-5-(3,5-ditert-butylphenyl)benzene;phosphorous acid
CID 162262845
diiodopalladium;bis(tris(3,5-ditert-butylphenyl)phosphanium)
CID 153412297
1,3-ditert-butyl-5-(2,4,4-trimethylpentan-2-yl)benzene
CID 19017896
N,N-bis(3,5-ditert-butylphenyl)hydroxylamine
CID 58984158
(3,5-ditert-butylphenoxy)phosphane
CID 59664555
1,3-ditert-butyl-5-(3,5-ditert-butylphenyl)sulfinylbenzene
CID 70574918
3,5-ditert-butylbenzonitrile
CID 3682565

Frequently Asked Questions

What is the IUPAC name of terbium;bis(1,3,5-tritert-butylbenzene)?
The IUPAC name of terbium;bis(1,3,5-tritert-butylbenzene) (CID 134902614) is terbium;bis(1,3,5-tritert-butylbenzene).
What is the SMILES notation for terbium;bis(1,3,5-tritert-butylbenzene)?
The canonical SMILES for terbium;bis(1,3,5-tritert-butylbenzene) is CC(C)(C)c1cc(C(C)(C)C)cc(C(C)(C)C)c1.CC(C)(C)c1cc(C(C)(C)C)cc(C(C)(C)C)c1.[Tb].
What is the InChIKey of terbium;bis(1,3,5-tritert-butylbenzene)?
The InChIKey is WKIHYYPJHGIHOA-UHFFFAOYSA-N. The full InChI is InChI=1S/2C18H30.Tb/c2*1-16(2,3)13-10-14(17(4,5)6)12-15(11-13)18(7,8)9;/h2*10-12H,1-9H3;.
What are the key properties of terbium;bis(1,3,5-tritert-butylbenzene)?
terbium;bis(1,3,5-tritert-butylbenzene) has a molecular weight of 651.80 g/mol, XLogP of 11.16, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for terbium;bis(1,3,5-tritert-butylbenzene) is sourced from PubChem (CID 134902614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).