dilithium;hydride;(2-methyl-1,3,3-triphenylpropyl)benzene

C28H28Li2 — CID 173113616

IUPACdilithium;hydride;(2-methyl-1,3,3-triphenylpropyl)benzene
SMILESCC(C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1.[H-].[H-].[Li+].[Li+]
InChIInChI=1S/C28H26.2Li.2H/c1-22(27(23-14-6-2-7-15-23)24-16-8-3-9-17-24)28(25-18-10-4-11-19-25)26-20-12-5-13-21-26;;;;/h2-22,27-28H,1H3;;;;/q;2*+1;2*-1
InChIKeyIAZSGMSTZPGHPM-UHFFFAOYSA-N
MW378.41 g/mol
LogP1.52
Rot. Bonds6

About dilithium;hydride;(2-methyl-1,3,3-triphenylpropyl)benzene

dilithium;hydride;(2-methyl-1,3,3-triphenylpropyl)benzene (PubChem CID 173113616) has the molecular formula C28H28Li2 and a molecular weight of 378.41 g/mol. Its IUPAC name is dilithium;hydride;(2-methyl-1,3,3-triphenylpropyl)benzene.

Molecular Properties

Compound Namedilithium;hydride;(2-methyl-1,3,3-triphenylpropyl)benzene
PubChem CID173113616
Molecular FormulaC28H28Li2
Molecular Weight378.41 g/mol
Exact Mass378.25
IUPAC Namedilithium;hydride;(2-methyl-1,3,3-triphenylpropyl)benzene
SMILESCC(C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1.[H-].[H-].[Li+].[Li+]
InChIInChI=1S/C28H26.2Li.2H/c1-22(27(23-14-6-2-7-15-23)24-16-8-3-9-17-24)28(25-18-10-4-11-19-25)26-20-12-5-13-21-26;;;;/h2-22,27-28H,1H3;;;;/q;2*+1;2*-1
InChIKeyIAZSGMSTZPGHPM-UHFFFAOYSA-N
XLogP1.52
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.41
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(2S,3S)-3-methyl-4,4-diphenylbutan-2-amine
CID 59951948
1,1-diphenylpropan-2-ylbenzene
CID 3664636
2-methyl-1,1-diphenylhexan-3-amine
CID 83047736
(3-methyl-1,1-diphenylbutan-2-yl)benzene
CID 91598963
1-phenylethylbenzene
CID 11918
1-phenylethylbenzene
CID 142851428
benzene;cumene
CID 157215889
cumene
CID 161227923
propan-2-ylcyclodecapentaene
CID 123508933
[(2R)-2-methoxy-1-phenylpropyl]benzene
CID 101223865
1-phenylethylbenzene;stibane
CID 174965918
cumene;2-methylpropane
CID 90828344

Frequently Asked Questions

What is the IUPAC name of dilithium;hydride;(2-methyl-1,3,3-triphenylpropyl)benzene?
The IUPAC name of dilithium;hydride;(2-methyl-1,3,3-triphenylpropyl)benzene (CID 173113616) is dilithium;hydride;(2-methyl-1,3,3-triphenylpropyl)benzene.
What is the SMILES notation for dilithium;hydride;(2-methyl-1,3,3-triphenylpropyl)benzene?
The canonical SMILES for dilithium;hydride;(2-methyl-1,3,3-triphenylpropyl)benzene is CC(C(c1ccccc1)c1ccccc1)C(c1ccccc1)c1ccccc1.[H-].[H-].[Li+].[Li+].
What is the InChIKey of dilithium;hydride;(2-methyl-1,3,3-triphenylpropyl)benzene?
The InChIKey is IAZSGMSTZPGHPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H26.2Li.2H/c1-22(27(23-14-6-2-7-15-23)24-16-8-3-9-17-24)28(25-18-10-4-11-19-25)26-20-12-5-13-21-26;;;;/h2-22,27-28H,1H3;;;;/q;2*+1;2*-1.
What are the key properties of dilithium;hydride;(2-methyl-1,3,3-triphenylpropyl)benzene?
dilithium;hydride;(2-methyl-1,3,3-triphenylpropyl)benzene has a molecular weight of 378.41 g/mol, XLogP of 1.52, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dilithium;hydride;(2-methyl-1,3,3-triphenylpropyl)benzene is sourced from PubChem (CID 173113616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).