(3-chloro-5-trimethylsilylpenta-1,4-diynyl)-trimethylsilane

C11H19ClSi2 — CID 102163014

IUPAC(3-chloro-5-trimethylsilylpenta-1,4-diynyl)-trimethylsilane
SMILESC[Si](C)(C)C#CC(Cl)C#C[Si](C)(C)C
InChIInChI=1S/C11H19ClSi2/c1-13(2,3)9-7-11(12)8-10-14(4,5)6/h11H,1-6H3
InChIKeyLCUCHIGHCBEOKN-UHFFFAOYSA-N
MW242.90 g/mol
LogP3.36
Rot. Bonds

About (3-chloro-5-trimethylsilylpenta-1,4-diynyl)-trimethylsilane

(3-chloro-5-trimethylsilylpenta-1,4-diynyl)-trimethylsilane (PubChem CID 102163014) has the molecular formula C11H19ClSi2 and a molecular weight of 242.90 g/mol. Its IUPAC name is (3-chloro-5-trimethylsilylpenta-1,4-diynyl)-trimethylsilane.

Molecular Properties

Compound Name(3-chloro-5-trimethylsilylpenta-1,4-diynyl)-trimethylsilane
PubChem CID102163014
Molecular FormulaC11H19ClSi2
Molecular Weight242.90 g/mol
Exact Mass242.07
IUPAC Name(3-chloro-5-trimethylsilylpenta-1,4-diynyl)-trimethylsilane
SMILESC[Si](C)(C)C#CC(Cl)C#C[Si](C)(C)C
InChIInChI=1S/C11H19ClSi2/c1-13(2,3)9-7-11(12)8-10-14(4,5)6/h11H,1-6H3
InChIKeyLCUCHIGHCBEOKN-UHFFFAOYSA-N
XLogP3.36
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.90
LogP ≤ 53.36
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

1-Chloro-5-(trimethylsilyl)-4-pentyne
CID 2757942
1-Chloro-5-triethylsilyl-1-pentyne
CID 16217488
(3-Chloro-3-fluoroprop-1-ynyl)-tri(propan-2-yl)silane
CID 10610604
(6-Chlorohex-1-yn-1-yl)trimethylsilane
CID 13839479
6-Chlorohex-1-ynyl(triethyl)silane
CID 102112680
(5-Chloropent-1-yn-1-yl)(triethyl)silane
CID 2757930
(3-Chloroprop-1-yn-1-yl)(triethyl)silane
CID 13162530
3-Chloroprop-1-ynyl-tri(propan-2-yl)silane
CID 86187348
(6-Chloro-1-triethylsilylhex-2-ynyl)-trimethylsilane
CID 166439280
8-Chloroocta-1,3-diynyl(trimethyl)silane
CID 176427253
1,2-Bis-(3-chloro-prop-1-ynyl)-1,1,2,2-tetramethyl-disilane
CID 10659211
(6-Chloro-1-hexyn-1-yl)tris(1-methylethyl)silane
CID 86039227

Frequently Asked Questions

What is the IUPAC name of (3-chloro-5-trimethylsilylpenta-1,4-diynyl)-trimethylsilane?
The IUPAC name of (3-chloro-5-trimethylsilylpenta-1,4-diynyl)-trimethylsilane (CID 102163014) is (3-chloro-5-trimethylsilylpenta-1,4-diynyl)-trimethylsilane.
What is the SMILES notation for (3-chloro-5-trimethylsilylpenta-1,4-diynyl)-trimethylsilane?
The canonical SMILES for (3-chloro-5-trimethylsilylpenta-1,4-diynyl)-trimethylsilane is C[Si](C)(C)C#CC(Cl)C#C[Si](C)(C)C.
What is the InChIKey of (3-chloro-5-trimethylsilylpenta-1,4-diynyl)-trimethylsilane?
The InChIKey is LCUCHIGHCBEOKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19ClSi2/c1-13(2,3)9-7-11(12)8-10-14(4,5)6/h11H,1-6H3.
What are the key properties of (3-chloro-5-trimethylsilylpenta-1,4-diynyl)-trimethylsilane?
(3-chloro-5-trimethylsilylpenta-1,4-diynyl)-trimethylsilane has a molecular weight of 242.90 g/mol, XLogP of 3.36, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chloro-5-trimethylsilylpenta-1,4-diynyl)-trimethylsilane is sourced from PubChem (CID 102163014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).