Basic information
- Standard SMILES
C[Si](C)(C)Cl- InChIKey
IJOOHPMOJXWVHK-UHFFFAOYSA-N- Molecular formula
- C3H9ClSi
- Average molar mass
- 108.64 g/mol
- Monoisotopic mass
- 108.0162045
Names & identifiers
- Preferred name
- Chlorotrimethylsilane
- IUPAC
- chloro(trimethyl)silane
- English name
- Chlorotrimethylsilane
- Molecular formula
- C3H9ClSi
- Molecular weight
- 108.64
Names & synonyms
Show more names
Database identifiers
- CAS
75-77-4- PubChem CID
- 6397
- DTXSID
DTXSID2024822- ChEMBL
CHEMBL1505385- ChEBI
CHEBI:85069- UNII
- 62UO4690X6
- EC Number
- 200-900-5
- Nikkaji
- J1.466D
Properties
Computed structural properties
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 5
- Formal charge
- 0
- Complexity
- 28
Physicochemical properties
- Melting point
- 40 °C · −40 °C(lit.)
- Boiling point
- 57 °C · 57 °C(lit.)
- Density
- 0.857 g/mL · 0.857 g/mL at 25 °C
- vapor density
- 3.7 · 3.7 (vs air)
- vapor pressure
- 100 mm · 100 mm Hg ( 25 °C)
- refractive index
- 20 · n20/D 1.500
- Flash point
- 104 °F · 104 °F
- storage temp.
- 30 °C · Store below +30°C.
- solubility
- Miscible with ether, benzene, diethylether and perchloroethylene.
- form
- Liquid
- Specific Gravity
- 0.8536 · 0.8536 (27℃)
- color
- Clear colorless
- explosive limit
- 1.5 · 1.5-46%(V)
- Water Solubility
- REACTS
- Sensitive
- Moisture Sensitive
- Hydrolytic Sensitivity
- 8 · 8: reacts rapidly with moisture, water, protic solvents
- BRN
- 1209232 · 1209232
- Stability
- Stable. Highly flammable - note low flash point. Reacts violently with water. Incompatible with water, moisture, strong oxidizing agents, strong acids, strong bases, aldehydes, alcohols, amines, esters, ketones.
- InChI
- 1S/C3H9ClSi/c1-5(2,3)4/h1-3H3
- InChIKey
- IJOOHPMOJXWVHK-UHFFFAOYSA-N
- SMILES
- C[Si](C)(C)Cl
- CAS DataBase Reference
- 75 · 75-77-4(CAS DataBase Reference)
- FDA UNII
- 62 UO4690X6 · 62UO4690X6
- NIST Chemistry Reference
- Silane, chlorotrimethyl-(75-77-4)
- EPA Substance Registry System
- Trimethylchlorosilane (75-77-4)
- UNSPSC Code
- 12352302 · 12352302
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 2 · GHS02,GHS05,GHS06,GHS08
- Signal word
- Danger
- Hazard statements
- 301 · H301+H331-H312-H314-H371-H225-H290
- Precautionary statements
- 501 · P501-P270-P240-P260-P210-P233-P234-P243-P241-P242-P271-P264-P280-P370+P378-P390-P308+P311-P362+P364-P303+P361+P353-P301+P330+P331-P301+P310+P330-P304+P340+P310-P305+P351+P338+P310-P403+P233-P403+P235-P406-P405
- PPE
- Faceshields, Gloves, Goggles
- Hazard Codes
- T,F,C,Xn
- Risk Statements
- 20 · 20/21-36/38-34-21-14-11-37-35-19-40-10-67-20/21/22-52
- Safety Statements
- 26 · 26-36/37/39-45-16-36/37-7/9
- RIDADR
- 1298 · UN 1298
- WGK Germany
- 2 · 2
- RTECS
- 2710000 · VV2710000
- F
- 10 · 10-21
- Autoignition Temperature
- 752 °F · 752 °F
- Hazard Note
- Highly Flammable/Corrosive/Moisture Sensitive
- TSCA
- TSCA listed
- HazardClass
- 3 · 3
- PackingGroup
- II
- HS Code
- 29310095 · 29310095
- Storage Class
- 3 · 3 - Flammable liquids
- Hazard Classifications
- 3 InhalationAcute · Acute Tox. 3 InhalationAcute Tox. 3 OralAcute Tox. 4 DermalEye Dam. 1Flam. Liq. 2Skin Corr. 1A
- Hazardous Substances Data
- 75 · 75-77-4(Hazardous Substances Data)
- Toxicity
- 50 orally · LD50 orally in Rabbit: 4868 mg/kg LD50 dermal Rabbit 1530 mg/kg
- REACH Registrations
- Active
- Excepted Quantities
- Not Permitted as Excepted Quantity
Safety & regulation
Safety data
- F
- 10-21
- PPE
- Faceshields, Gloves, Goggles
- wgk
- 2
- tsca
- TSCA listed
- rtecs
- VV2710000
- ridadr
- UN 1298
- hs_code
- 29310095
- Toxicity
- LD50 orally in Rabbit: 4868 mg/kg LD50 dermal Rabbit 1530 mg/kg
- risk_code
- 20/21-36/38-34-21-14-11-37-35-19-40-10-67-20/21/22-52
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS05,GHS06,GHS08
- hazard_code
- T,F,C,Xn
- hazard_note
- Highly Flammable/Corrosive/Moisture Sensitive
- safety_code
- 26-36/37/39-45-16-36/37-7/9
- hazard_class
- 3
- Storage Class
- 3 - Flammable liquids
- packing_group
- II
- Hazard statements
- H301+H331-H312-H314-H371-H225-H290
- Excepted Quantities
- Not Permitted as Excepted Quantity
- REACH Registrations
- Active
- Hazard Classifications
- Acute Tox. 3 InhalationAcute Tox. 3 OralAcute Tox. 4 DermalEye Dam. 1Flam. Liq. 2Skin Corr. 1A
- Autoignition Temperature
- 752 °F
- Precautionary statements
- P501-P270-P240-P260-P210-P233-P234-P243-P241-P242-P271-P264-P280-P370+P378-P390-P308+P311-P362+P364-P303+P361+P353-P301+P330+P331-P301+P310+P330-P304+P340+P310-P305+P351+P338+P310-P403+P233-P403+P235-P406-P405
- Hazardous Substances Data
- 75-77-4(Hazardous Substances Data)
Chemistry & industry
Applications
DescriptionChlorotrimethylsilane is a valuable reagent for the protection of the hydroxyl function in organic synthesis. It should be distilled from calciumhydride (or tributylamine) under nitrogen before use,and stored and weighed under nitrogen. Use of the reagent without purification has been reported to lead to explosions. Chlorotrimethylsilane may contain dichlorodimethylsilane as an impurity. This may be removed before distillation by very cautious treatment with a small amount of water,which hydrolyses the dichloro compound more rapidly. Excess chlorotrimethylsilane in a reaction mixture may be destroyed by the very careful addition of aqueous sodium hydrogencarbonate solution.
UsesChlorotrimethylsilane is a typical Silane Blocking Agent, which can protect or deprotect functional groups selectively. It have been used in the preparation of volatile derivatives of a wide range of compounds for GC analysis, and used for silylation and as a protection group in the process of various organic synthesis. It is used in the production of trimethylsilyl halides, pseudohalides and various organic silicon compounds. It is also used to produce hexamethyldisilane by reduction.
General DescriptionTrimethylchlorosilane appears as a colorless fuming liquid with a pungent odor. Boiling point 135° F, Flash point -18°F. Density 0.854g/cm3. The vapor and liquid may cause burns. Vapors are heavier than air.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers1 total
Additional notes
DefinitionChEBI: Chlorotrimethylsilane is a silyl chloride consisting of a central silicon atom covalently bound to one chloro and three methyl groups. Chlorotrimethylsilane is a derivatisation agent used in gas chromatography/mass spectrometry applications. It has a role as a chromatographic reagent.
Related reactions
Linked notes
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