Basic information
- CAS
1873-88-7- Standard SMILES
C[SiH](O[Si](C)(C)C)O[Si](C)(C)C- InChIKey
QNWOFLWXQGHSRH-UHFFFAOYSA-N- Molecular formula
- C7H22O2Si3
- Average molar mass
- 222.5 g/mol
- Monoisotopic mass
- 222.09275953
Names & identifiers
- Preferred name
- Trimethyl-[methyl(trimethylsilyloxy)silyl]oxysilane
- IUPAC
- trimethyl-[methyl(trimethylsilyloxy)silyl]oxysilane
- English name
- 1,1,1,3,5,5,5-Heptamethyltrisiloxane
- Molecular formula
- C7H22O2Si3
- Molecular weight
- 222.5
Names & synonyms
Show more names
Database identifiers
- CAS
1873-88-7- PubChem CID
- 74640
- DTXSID
DTXSID1038795
Properties
Computed structural properties
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 121
Experimental & physicochemical properties
Physicochemical properties
- Melting point
- 0 °C · <0°C
- Boiling point
- 142 °C · 142 °C (lit.)
- Density
- 0.819 g/mL · 0.819 g/mL at 25 °C (lit.)
- vapor pressure
- 8.5 hPa · 8.5hPa at 25℃
- refractive index
- 20 · n20/D 1.382(lit.)
- Flash point
- 82 °F · 82 °F
- storage temp.
- 15 · 15-25°C
- solubility
- Chloroform (Soluble), Methanol (Slightly)
- form
- clear liquid
- Specific Gravity
- 0.8136 · 0.8136
- color
- Colorless to Almost colorless
- Viscosity
- 1.1 mm2/s · 1.1mm2/s
- Water Solubility
- Miscible with acetone, ethanol, diethyl ether. Insoluble in water.
- Hydrolytic Sensitivity
- 3 · 3: reacts with aqueous base
- BRN
- 1748455 · 1748455
- Henry's Law Constant
- 1.1 · 1.1×10-7 mol/(m3Pa) at 25℃, Ebert et al. (2023)
- Stability
- Stable. Flammable. Incompatible with strong oxidizing agents.
- InChI
- 1S/C7H22O2Si3/c1-10(8-11(2,3)4)9-12(5,6)7/h10H,1-7H3
- InChIKey
- QNWOFLWXQGHSRH-UHFFFAOYSA-N
- SMILES
- C[SiH](O[Si](C)(C)C)O[Si](C)(C)C
- LogP
- 6.2 at · 6.2 at 20℃
- CAS DataBase Reference
- 1873 · 1873-88-7(CAS DataBase Reference)
- FDA UNII
- 9659 R8C · RVY9659R8C
- NIST Chemistry Reference
- 1 · Trisiloxane, 1,1,1,3,5,5,5-heptamethyl-,(1873-88-7)
- EPA Substance Registry System
- 1 · Trisiloxane, 1,1,1,3,5,5,5-heptamethyl- (1873-88-7)
- UNSPSC Code
- 41116107 · 41116107
- NACRES
- 24 · NA.24
- Symbol(GHS)
- 2 · GHS02,GHS07
- Signal word
- Danger
- Hazard statements
- 225 · H225-H315-H319-H335
- Precautionary statements
- 210 · P210-P302+P352-P305+P351+P338
- target organs
- Respiratory system
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- Hazard Codes
- Xi
- Risk Statements
- 10 · 10-36/37/38
- Safety Statements
- 26 · 26-36
- RIDADR
- 1993 · UN 1993 3/PG 2
- WGK Germany
- 3 · 3
- F
- 10 · 10-21
- TSCA
- TSCA listed
- HazardClass
- 3 · 3
- PackingGroup
- II
- HS Code
- 29319090 · 29319090
- Storage Class
- 3 · 3 - Flammable liquids
- Hazard Classifications
- 2 Flam · Eye Irrit. 2Flam. Liq. 2Skin Irrit. 2STOT SE 3
- REACH Registrations
- Active
Safety & regulation
Safety data
- F
- 10-21
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 1993 3/PG 2
- hs_code
- 29319090
- risk_code
- 10-36/37/38
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS07
- hazard_code
- Xi
- safety_code
- 26-36
- hazard_class
- 3
- Storage Class
- 3 - Flammable liquids
- packing_group
- II
- target organs
- Respiratory system
- Hazard statements
- H225-H315-H319-H335
- REACH Registrations
- Active
- Hazard Classifications
- Eye Irrit. 2Flam. Liq. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P210-P302+P352-P305+P351+P338
Chemistry & industry
Applications
UsesHeptamethyltrisiloxane is used to catalyze reduction reactions in organic syntheses.
DescriptionBis (trimethylsiloxy) methylsilane acts as an important raw material and intermediate used in organic synthesis, pharmaceutical and dyestuff. For example, it can be used for the platinum-catalyzed aromatic C-H silylation of arenes. It can also be used for the silylation of aryl iodides.
Uses1,1,1,3,5,5,5-Heptamethyltrisiloxane is a Basic material for synthetic polyalkyleneoxide modified heptamethyltrisiloxane which is a kind of specific structure surfactant for pesticide additives, coating additives, etc.
UsesBis(trimethylsiloxy)methylsilane is an important raw material and intermediate used in organic synthesis, pharmaceutical and dyestuff.
Uses1,1,1,3,5,5,5-Heptamethyltrisiloxane can be used for the aromatic C-H silylation of arenes in the presence of a platinum complex catalyst.It can also be used as a reagent to synthesize: 3-Octyl-1,1,1,3,5,5,5-heptamethyltrisiloxane, an agricultural adjuvant and sensory performance enhancer used in cosmetic formulations.Isoindigo-based conjugated polymer with siloxane-terminated solubilizing group.Monosiloxy esters with a variety of acids.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers100 total
Related reactions
Compound notes
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