(1,3-ditert-butyl-2-chloro-1,3,2-diazasilol-2-yl)methyl-trimethylsilane

C14H31ClN2Si2 — CID 101332210

IUPAC(1,3-ditert-butyl-2-chloro-1,3,2-diazasilol-2-yl)methyl-trimethylsilane
SMILESCC(C)(C)N1C=CN(C(C)(C)C)[Si]1(Cl)C[Si](C)(C)C
InChIInChI=1S/C14H31ClN2Si2/c1-13(2,3)16-10-11-17(14(4,5)6)19(16,15)12-18(7,8)9/h10-11H,12H2,1-9H3
InChIKeyRFLCNQJZBDPDAF-UHFFFAOYSA-N
MW319.04 g/mol
LogP4.73
Rot. Bonds2

About (1,3-ditert-butyl-2-chloro-1,3,2-diazasilol-2-yl)methyl-trimethylsilane

(1,3-ditert-butyl-2-chloro-1,3,2-diazasilol-2-yl)methyl-trimethylsilane (PubChem CID 101332210) has the molecular formula C14H31ClN2Si2 and a molecular weight of 319.04 g/mol. Its IUPAC name is (1,3-ditert-butyl-2-chloro-1,3,2-diazasilol-2-yl)methyl-trimethylsilane.

Molecular Properties

Compound Name(1,3-ditert-butyl-2-chloro-1,3,2-diazasilol-2-yl)methyl-trimethylsilane
PubChem CID101332210
Molecular FormulaC14H31ClN2Si2
Molecular Weight319.04 g/mol
Exact Mass318.17
IUPAC Name(1,3-ditert-butyl-2-chloro-1,3,2-diazasilol-2-yl)methyl-trimethylsilane
SMILESCC(C)(C)N1C=CN(C(C)(C)C)[Si]1(Cl)C[Si](C)(C)C
InChIInChI=1S/C14H31ClN2Si2/c1-13(2,3)16-10-11-17(14(4,5)6)19(16,15)12-18(7,8)9/h10-11H,12H2,1-9H3
InChIKeyRFLCNQJZBDPDAF-UHFFFAOYSA-N
XLogP4.73
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.04
LogP ≤ 54.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1,3-ditert-butyl-2-chloro-1,3,2-diazasilol-2-yl)methyl-trimethylsilane?
The IUPAC name of (1,3-ditert-butyl-2-chloro-1,3,2-diazasilol-2-yl)methyl-trimethylsilane (CID 101332210) is (1,3-ditert-butyl-2-chloro-1,3,2-diazasilol-2-yl)methyl-trimethylsilane.
What is the SMILES notation for (1,3-ditert-butyl-2-chloro-1,3,2-diazasilol-2-yl)methyl-trimethylsilane?
The canonical SMILES for (1,3-ditert-butyl-2-chloro-1,3,2-diazasilol-2-yl)methyl-trimethylsilane is CC(C)(C)N1C=CN(C(C)(C)C)[Si]1(Cl)C[Si](C)(C)C.
What is the InChIKey of (1,3-ditert-butyl-2-chloro-1,3,2-diazasilol-2-yl)methyl-trimethylsilane?
The InChIKey is RFLCNQJZBDPDAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31ClN2Si2/c1-13(2,3)16-10-11-17(14(4,5)6)19(16,15)12-18(7,8)9/h10-11H,12H2,1-9H3.
What are the key properties of (1,3-ditert-butyl-2-chloro-1,3,2-diazasilol-2-yl)methyl-trimethylsilane?
(1,3-ditert-butyl-2-chloro-1,3,2-diazasilol-2-yl)methyl-trimethylsilane has a molecular weight of 319.04 g/mol, XLogP of 4.73, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1,3-ditert-butyl-2-chloro-1,3,2-diazasilol-2-yl)methyl-trimethylsilane is sourced from PubChem (CID 101332210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).