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3-Bromopropyltrichlorosilane

HCID 83792
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
13883-39-1
Standard SMILES
Cl[Si](Cl)(Cl)CCCBr
InChIKey
UUNGBOQAZQUJMZ-UHFFFAOYSA-N
Molecular formula
C3H6BrCl3Si
Average molar mass
256.42 g/mol
Monoisotopic mass
253.84877

Names & identifiers

Preferred name
3-Bromopropyltrichlorosilane
IUPAC
3-bromopropyl(trichloro)silane
English name
3-BROMOPROPYLTRICHLOROSILANE
Molecular formula
C3H6BrCl3Si
Molecular weight
256.43

Names & synonyms

3-Bromopropyltrichlorosilane(3-Bromopropyl)trichlorosilaneSilane, (3-bromopropyl)trichloro-V522CH6BQ4DTXSID7065671RefChem:93264(3bromopropyl)trichlorosilaneSilane, (3bromopropyl)trichloroDTXCID6034500237-650-1UN2986UUNGBOQAZQUJMZ-UHFFFAOYSA-N
Show more names
DK535(3-bromopropyl)trichloro-silan3-(Trichlorosilyl)propyl bromide
13883-39-13-bromopropyl(trichloro)silaneMFCD00039291C3H6BrCl3SiEINECS 237-650-1UNII-V522CH6BQ43-bromopropyl-trichlorosilaneSCHEMBL756795

Database identifiers

CAS
13883-39-1
PubChem CID
83792
DTXSID
DTXSID7065671
UNII
V522CH6BQ4
EC Number
237-650-1
Nikkaji
J280.359C

Properties

Computed structural propertiesFilling in

Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
2
Heavy atoms
8
Formal charge
0
Complexity
62

Experimental & physicochemical properties

Chemical ClassesToxic Gases & Vapors -> Chlorosilanes
SpringerMaterials PropertiesNuclear quadrupole resonance spectroscopy
Physical DescriptionColorless to yellow liquid; [Alfa Aesar MSDS]

Physicochemical properties

Boiling point
202 · 202-204 °C(lit.)
Density
1.605 g/mL · 1.605 g/mL at 25 °C(lit.)
refractive index
20 · n20/D 1.494(lit.)
Flash point
169 °F · 169 °F
storage temp.
Store at room temperature, keep dry and cool
form
clear liquid
color
Colorless to Light yellow
Specific Gravity
1.618 · 1.618
Hydrolytic Sensitivity
8 · 8: reacts rapidly with moisture, water, protic solvents

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Danger

H226 (92.9%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 42 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazards SummaryReacts with water; Causes burns; [Alfa Aesar MSDS] See Trichloropropylsilane.
Hazard Classes and CategoriesFlam. Liq. 3 (92.9%)

Safety & protection

Exposure Control and Personal Protection · 1 item

TIH (Toxic Inhalation Hazard) - Term used to describe gases and volatile liquids that are toxic when inhaled. Some are TIH materials themselves, e.g., chlorine, and some release TIH gases when spilled in water, e.g., chlorosilanes. [ERG 2016].

Toxicology

Adverse EffectsDermatotoxin - Skin burns.

Safety data

F
10-21
PPE
Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter

Chemistry & industry

Uses & manufacturing

UsesToxic Gas from Spilling Chemical in Water [Category: Other]
General Manufacturing InformationSilane, (3-bromopropyl)trichloro-: ACTIVE
Applications · 1 item

Uses(3-Bromopropyl)trichlorosilane can be used: To prepare coupling agent 3-iodopropyltrichlorosilane (3-IC3H6SiCl3), which is employed for the preparation of self-assembled nonlinear optically (NLO) active chromophoric multilayers. As a reagent for the surface modification of silica nanofiber films and silica particles.

Upstream & downstream products

Downstream products

3-BROMOPROPYLTRIMETHOXYSILANE

Related reactions

1 records
New reaction record
HRID 589221 reaction equation
HRID 589221As reactantuspto-grants-2016_01

Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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BRN
1737852 · 1737852
InChI
1S/C3H6BrCl3Si/c4-2-1-3-8(5,6)7/h1-3H2
InChIKey
UUNGBOQAZQUJMZ-UHFFFAOYSA-N
SMILES
Cl[Si](Cl)(Cl)CCCBr
CAS DataBase Reference
13883 · 13883-39-1
FDA UNII
522 CH6BQ4 · V522CH6BQ4
EPA Substance Registry System
Silane, (3-bromopropyl)trichloro- (13883-39-1)
UNSPSC Code
12352101 · 12352101
NACRES
22 · NA.22
Symbol(GHS)
2 · GHS02,GHS05
Signal word
Danger
Hazard statements
226 · H226-H314
Precautionary statements
210 · P210-P233-P240-P280-P303+P361+P353-P305+P351+P338
PPE
Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
Hazard Codes
C
Risk Statements
14 · 14-29-34
Safety Statements
26 · 26-36/37/39-45-28
RIDADR
2987 · UN 2987 8/PG 2
WGK Germany
3 · 3
F
10 · 10-21
TSCA
TSCA listed
HS Code
2931.9 · 2931.90.9010
Storage Class
3 · 3 - Flammable liquids
Hazard Classifications
3 Skin · Flam. Liq. 3Skin Corr. 1B
wgk
3
tsca
TSCA listed
ridadr
UN 2987 8/PG 2
hs_code
2931.90.9010
risk_code
14-29-34
Signal word
Danger
Symbol(GHS)
GHS02,GHS05
hazard_code
C
safety_code
26-36/37/39-45-28
Storage Class
3 - Flammable liquids
Hazard statements
H226-H314
Hazard Classifications
Flam. Liq. 3Skin Corr. 1B
Precautionary statements
P210-P233-P240-P280-P303+P361+P353-P305+P351+P338