CID 134901980

C20H30Cl2SiTh — CID 134901980

IUPAC—
SMILESC[C]1[C](C)[C](C)[C]([Si](C)(C)[C]2[C](C)[C](C)[C](C)[C]2C)[C]1C.Cl[Th]Cl
InChIInChI=1S/C20H30Si.2ClH.Th/c1-11-12(2)16(6)19(15(11)5)21(9,10)20-17(7)13(3)14(4)18(20)8;;;/h1-10H3;2*1H;/q;;;+2/p-2
InChIKeyGAUOGMBQNSWKGS-UHFFFAOYSA-L
MW601.49 g/mol
LogP7.08
Rot. Bonds2

About CID 134901980

CID 134901980 (PubChem CID 134901980) has the molecular formula C20H30Cl2SiTh and a molecular weight of 601.49 g/mol.

Molecular Properties

Compound NameCID 134901980
PubChem CID134901980
Molecular FormulaC20H30Cl2SiTh
Molecular Weight601.49 g/mol
Exact Mass600.19
IUPAC Name—
SMILESC[C]1[C](C)[C](C)[C]([Si](C)(C)[C]2[C](C)[C](C)[C](C)[C]2C)[C]1C.Cl[Th]Cl
InChIInChI=1S/C20H30Si.2ClH.Th/c1-11-12(2)16(6)19(15(11)5)21(9,10)20-17(7)13(3)14(4)18(20)8;;;/h1-10H3;2*1H;/q;;;+2/p-2
InChIKeyGAUOGMBQNSWKGS-UHFFFAOYSA-L
XLogP7.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500601.49
LogP ≤ 57.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

CID 134882043
CID 134882043
CID 134902093
CID 134902093
CID 134902262
CID 134902262
CID 134991311
CID 134991311
CID 135046370
CID 135046370
CID 135046650
CID 135046650
CID 135046651
CID 135046651
CID 135046895
CID 135046895
CID 176422605
CID 176422605
Dimethyl-bis(2,3,4,5-tetramethylcyclopentyl)silane
CID 23228943
dimethyl-[(2R,3R)-2,3,4,5-tetramethylcyclopentyl]-[(2R,4R,5R)-2,3,4,5-tetramethylcyclopentyl]silane
CID 58150598
[(3S)-3,4-dimethylcyclopentyl]-dimethyl-[(1S,3S)-3-methylcyclopentyl]silane
CID 58219611

Frequently Asked Questions

What is the IUPAC name of CID 134901980?
The IUPAC name of CID 134901980 (CID 134901980) is not available.
What is the SMILES notation for CID 134901980?
The canonical SMILES for CID 134901980 is C[C]1[C](C)[C](C)[C]([Si](C)(C)[C]2[C](C)[C](C)[C](C)[C]2C)[C]1C.Cl[Th]Cl.
What is the InChIKey of CID 134901980?
The InChIKey is GAUOGMBQNSWKGS-UHFFFAOYSA-L. The full InChI is InChI=1S/C20H30Si.2ClH.Th/c1-11-12(2)16(6)19(15(11)5)21(9,10)20-17(7)13(3)14(4)18(20)8;;;/h1-10H3;2*1H;/q;;;+2/p-2.
What are the key properties of CID 134901980?
CID 134901980 has a molecular weight of 601.49 g/mol, XLogP of 7.08, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134901980 is sourced from PubChem (CID 134901980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).