3-chloroprop-1-ynyl-[2-[3-chloroprop-1-ynyl(dimethyl)silyl]ethyl]-dimethylsilane

C12H20Cl2Si2 — CID 15436160

IUPAC3-chloroprop-1-ynyl-[2-[3-chloroprop-1-ynyl(dimethyl)silyl]ethyl]-dimethylsilane
SMILESC[Si](C)(C#CCCl)CC[Si](C)(C)C#CCCl
InChIInChI=1S/C12H20Cl2Si2/c1-15(2,9-5-7-13)11-12-16(3,4)10-6-8-14/h7-8,11-12H2,1-4H3
InChIKeyKSVMQFNAZLSWTA-UHFFFAOYSA-N
MW291.37 g/mol
LogP3.97
Rot. Bonds3

About 3-chloroprop-1-ynyl-[2-[3-chloroprop-1-ynyl(dimethyl)silyl]ethyl]-dimethylsilane

3-chloroprop-1-ynyl-[2-[3-chloroprop-1-ynyl(dimethyl)silyl]ethyl]-dimethylsilane (PubChem CID 15436160) has the molecular formula C12H20Cl2Si2 and a molecular weight of 291.37 g/mol. Its IUPAC name is 3-chloroprop-1-ynyl-[2-[3-chloroprop-1-ynyl(dimethyl)silyl]ethyl]-dimethylsilane.

Molecular Properties

Compound Name3-chloroprop-1-ynyl-[2-[3-chloroprop-1-ynyl(dimethyl)silyl]ethyl]-dimethylsilane
PubChem CID15436160
Molecular FormulaC12H20Cl2Si2
Molecular Weight291.37 g/mol
Exact Mass290.05
IUPAC Name3-chloroprop-1-ynyl-[2-[3-chloroprop-1-ynyl(dimethyl)silyl]ethyl]-dimethylsilane
SMILESC[Si](C)(C#CCCl)CC[Si](C)(C)C#CCCl
InChIInChI=1S/C12H20Cl2Si2/c1-15(2,9-5-7-13)11-12-16(3,4)10-6-8-14/h7-8,11-12H2,1-4H3
InChIKeyKSVMQFNAZLSWTA-UHFFFAOYSA-N
XLogP3.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.37
LogP ≤ 53.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(3-Chloro-3-fluoroprop-1-ynyl)-tri(propan-2-yl)silane
CID 10610604
(3-Chloroprop-1-yn-1-yl)(triethyl)silane
CID 13162530
3-Chloroprop-1-ynyl-tri(propan-2-yl)silane
CID 86187348
Bis(chloromethyl)tetramethyldisilylethyne
CID 129769519
(6-Chloro-1-triethylsilylhex-2-ynyl)-trimethylsilane
CID 166439280
1,2-Bis-(3-chloro-prop-1-ynyl)-1,1,2,2-tetramethyl-disilane
CID 10659211
1-Chloroprop-2-ynyl-tri(propan-2-yl)silane
CID 140111668
Tert-butyl-(1-chloroprop-2-ynyl)-dimethylsilane
CID 140111750
1-Chloroprop-2-ynyl(triethyl)silane
CID 140111772
1-Chloroprop-2-ynyl(tripropyl)silane
CID 140111816
CID 167431813
CID 167431813
2-Chloropropyl-[2-(2-chloropropylsilyl)ethyl]silane
CID 174050430

Frequently Asked Questions

What is the IUPAC name of 3-chloroprop-1-ynyl-[2-[3-chloroprop-1-ynyl(dimethyl)silyl]ethyl]-dimethylsilane?
The IUPAC name of 3-chloroprop-1-ynyl-[2-[3-chloroprop-1-ynyl(dimethyl)silyl]ethyl]-dimethylsilane (CID 15436160) is 3-chloroprop-1-ynyl-[2-[3-chloroprop-1-ynyl(dimethyl)silyl]ethyl]-dimethylsilane.
What is the SMILES notation for 3-chloroprop-1-ynyl-[2-[3-chloroprop-1-ynyl(dimethyl)silyl]ethyl]-dimethylsilane?
The canonical SMILES for 3-chloroprop-1-ynyl-[2-[3-chloroprop-1-ynyl(dimethyl)silyl]ethyl]-dimethylsilane is C[Si](C)(C#CCCl)CC[Si](C)(C)C#CCCl.
What is the InChIKey of 3-chloroprop-1-ynyl-[2-[3-chloroprop-1-ynyl(dimethyl)silyl]ethyl]-dimethylsilane?
The InChIKey is KSVMQFNAZLSWTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20Cl2Si2/c1-15(2,9-5-7-13)11-12-16(3,4)10-6-8-14/h7-8,11-12H2,1-4H3.
What are the key properties of 3-chloroprop-1-ynyl-[2-[3-chloroprop-1-ynyl(dimethyl)silyl]ethyl]-dimethylsilane?
3-chloroprop-1-ynyl-[2-[3-chloroprop-1-ynyl(dimethyl)silyl]ethyl]-dimethylsilane has a molecular weight of 291.37 g/mol, XLogP of 3.97, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloroprop-1-ynyl-[2-[3-chloroprop-1-ynyl(dimethyl)silyl]ethyl]-dimethylsilane is sourced from PubChem (CID 15436160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).