carbanide;1,2,4,5,6,7-hexahydroinden-2-id-1-ylmethylsilane;titanium(4+)

C13H24SiTi — CID 173302708

IUPACcarbanide;1,2,4,5,6,7-hexahydroinden-2-id-1-ylmethylsilane;titanium(4+)
SMILES[CH3-].[CH3-].[CH3-].[SiH3]CC1[C-]=CC2=C1CCCC2.[Ti+4]
InChIInChI=1S/C10H15Si.3CH3.Ti/c11-7-9-6-5-8-3-1-2-4-10(8)9;;;;/h5,9H,1-4,7H2,11H3;3*1H3;/q4*-1;+4
InChIKeyQVUXXUVLCYFDME-UHFFFAOYSA-N
MW256.29 g/mol
LogP2.98
Rot. Bonds1

About carbanide;1,2,4,5,6,7-hexahydroinden-2-id-1-ylmethylsilane;titanium(4+)

carbanide;1,2,4,5,6,7-hexahydroinden-2-id-1-ylmethylsilane;titanium(4+) (PubChem CID 173302708) has the molecular formula C13H24SiTi and a molecular weight of 256.29 g/mol. Its IUPAC name is carbanide;1,2,4,5,6,7-hexahydroinden-2-id-1-ylmethylsilane;titanium(4+).

Molecular Properties

Compound Namecarbanide;1,2,4,5,6,7-hexahydroinden-2-id-1-ylmethylsilane;titanium(4+)
PubChem CID173302708
Molecular FormulaC13H24SiTi
Molecular Weight256.29 g/mol
Exact Mass256.11
IUPAC Namecarbanide;1,2,4,5,6,7-hexahydroinden-2-id-1-ylmethylsilane;titanium(4+)
SMILES[CH3-].[CH3-].[CH3-].[SiH3]CC1[C-]=CC2=C1CCCC2.[Ti+4]
InChIInChI=1S/C10H15Si.3CH3.Ti/c11-7-9-6-5-8-3-1-2-4-10(8)9;;;;/h5,9H,1-4,7H2,11H3;3*1H3;/q4*-1;+4
InChIKeyQVUXXUVLCYFDME-UHFFFAOYSA-N
XLogP2.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.29
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

1-methyl-1,2,4,5,6,7-hexahydroinden-2-ide;1-(2-methylpropyl)-1,2-dihydroinden-2-ide;titanium(4+);dichloride
CID 158169488
carbanide;5-methylcyclopenta-1,3-diene;1-methyl-1,2,4,5,6,7-hexahydroinden-2-ide;zirconium(4+)
CID 151848047
[(1R)-1,2,4,5,6,7-hexahydroinden-2-id-1-yl]oxy-dimethyl-(2-methylpentan-2-yl)silane;[(1S)-1,2,4,5,6,7-hexahydroinden-2-id-1-yl]oxy-dimethyl-(2-methylpentan-2-yl)silane;zirconium(4+);dichloride
CID 18683641
carbanide;1-[2-[(1R)-4,5,6,7-tetrahydro-1H-inden-1-yl]ethyl]-4,5,6,7-tetrahydro-1H-indene;titanium(2+)
CID 22831435
1H-inden-1-ide;1-methyl-1,2,4,5,6,7-hexahydroinden-2-ide;zirconium(4+);dibromide
CID 157369632
lithium;hydride;4,5,6,7-tetrahydro-1H-inden-1-ylsilane
CID 173341675
N,N-dimethyl-2,3,4,7,8,9-hexahydro-1H-benzo[7]annulen-9-amine;hydrochloride
CID 138398306
heptacyclo[16.6.0.02,9.03,8.010,17.011,16.019,24]tetracosa-3(8),11(16),19(24)-triene
CID 101440290
1,2,3,3a,6,7,8,9,10,10b-decahydrocyclohepta[e]indene
CID 178126161
2-chloro-1-[1-(2-chloro-4,5,6,7-tetrahydro-1H-inden-1-yl)ethyl]-4,5,6,7-tetrahydro-1H-indene
CID 140968404
1-chloro-4,5,6,7-tetrahydro-1H-indene;ethanol;titanium
CID 88524321
10-ethenyl-1,2,3,4,4a,5,6,7,8,10a-decahydrophenanthrene
CID 59819079

Frequently Asked Questions

What is the IUPAC name of carbanide;1,2,4,5,6,7-hexahydroinden-2-id-1-ylmethylsilane;titanium(4+)?
The IUPAC name of carbanide;1,2,4,5,6,7-hexahydroinden-2-id-1-ylmethylsilane;titanium(4+) (CID 173302708) is carbanide;1,2,4,5,6,7-hexahydroinden-2-id-1-ylmethylsilane;titanium(4+).
What is the SMILES notation for carbanide;1,2,4,5,6,7-hexahydroinden-2-id-1-ylmethylsilane;titanium(4+)?
The canonical SMILES for carbanide;1,2,4,5,6,7-hexahydroinden-2-id-1-ylmethylsilane;titanium(4+) is [CH3-].[CH3-].[CH3-].[SiH3]CC1[C-]=CC2=C1CCCC2.[Ti+4].
What is the InChIKey of carbanide;1,2,4,5,6,7-hexahydroinden-2-id-1-ylmethylsilane;titanium(4+)?
The InChIKey is QVUXXUVLCYFDME-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15Si.3CH3.Ti/c11-7-9-6-5-8-3-1-2-4-10(8)9;;;;/h5,9H,1-4,7H2,11H3;3*1H3;/q4*-1;+4.
What are the key properties of carbanide;1,2,4,5,6,7-hexahydroinden-2-id-1-ylmethylsilane;titanium(4+)?
carbanide;1,2,4,5,6,7-hexahydroinden-2-id-1-ylmethylsilane;titanium(4+) has a molecular weight of 256.29 g/mol, XLogP of 2.98, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;1,2,4,5,6,7-hexahydroinden-2-id-1-ylmethylsilane;titanium(4+) is sourced from PubChem (CID 173302708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).