1,2-ETHANEDIYLBIS(METHYLSILANE) structure

3D Mol Similar

1,2-ETHANEDIYLBIS(METHYLSILANE)

: CAS No.: 4405-22-5; Molecular Weight：118.326; Modify Date.: 2022-11-29 13:14

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1. Names and Identifiers

: 1.1 Name; 1,2-ETHANEDIYLBIS(METHYLSILANE); 1.2 Synonyms; 1,1'-(1,2-Ethanediyl)bis[1-Methyl-silane] 1,2-ETHANEDIYLBIS(METHYLSILANE) 1,4-DIMETHYLDISILYLETHANE 2,5-Disilahexane ethane-1,2-diylbis(Methylsilane) Silane, 1,1'-(1,2-ethanediyl)bis[1-methyl-

1.3 CAS No.: 4405-22-5

1.4 CID: 15810336

1.5 Molecular Formula: C4H14Si2 (isomer)

1.6 Inchi: CBXZGERYGLVXSG-UHFFFAOYSA-N

1.7 InChIkey: CBXZGERYGLVXSG-UHFFFAOYSA-N

1.8 Canonical Smiles: C[SiH2]CC[SiH2]C

1.9 Isomers Smiles: C[SiH2]CC[SiH2]C

2. Properties

2.1 Density: 0.725 g/mL at 25 °C(lit.)

2.1 Boiling point: 95-96 °C(lit.)

2.1 Refractive index: n20/D 1.422(lit.)

2.1 Flash Point: -12 °C

2.1 Precise Quality: 118.06300

2.1 PSA: 0.00000

2.1 logP: 0.25680

3. Safety and Handling

3.1 Hazard Codes: F

3.1 Risk Statements: 11

3.1 Safety Statements: 16

3.1 RIDADR: UN 1993 3/PG 1

3.1 WGK Germany: 3

3.1 Safety: Hazard Codes FRisk Statements 11Safety Statements 16RIDADR UN 1993 3/PG 1 WGK Germany 3 TSCA No

4. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s)	no data available
Signal word	no data available
Hazard statement(s)	no data available
Precautionary statement(s)
Prevention	no data available
Response	no data available
Storage	no data available
Disposal	no data available

2.3 Other hazards which do not result in classification

no data available

View all

5. NMR Spectrum

13C NMR : Predict

1H NMR : Predict

6. Synthesis Route

4405-22-5Total: 1 Synthesis Route

3353-69-3 24 Suppliers

4405-22-5 9 Suppliers

Literatures:
Nametkin,N.S. et al. Doklady Chemistry, 1971 , vol. 197, p. 213 - 216 Dokl. Akad. Nauk SSSR Ser. Khim., 1971 , vol. 197, p. 351 - 354
Yield: null

7. Precursor and Product

precursor:

3353-69-3

8. Computational chemical data

Molecular Weight: 118.326g/mol
Molecular Formula: C₄H₁₄Si₂
Compound Is Canonicalized: True
XLogP3-AA:
Exact Mass: 114.03210339
Monoisotopic Mass: 114.03210339
Complexity: 17.5
Rotatable Bond Count: 3
Hydrogen Bond Donor Count: 0
Hydrogen Bond Acceptor Count: 0
Topological Polar Surface Area: 0
Heavy Atom Count: 6
Defined Atom Stereocenter Count: 0
Undefined Atom Stereocenter Count: 0
Defined Bond Stereocenter Count: 0
Undefined Bond Stereocenter Count: 0
Isotope Atom Count: 0
Covalently-Bonded Unit Count: 1
CACTVS Substructure Key Fingerprint: AAADccBgAAwAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGBAAAAAAAACAIABCAAAAAAEAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==