Magnesium, bromooctyl-
Basic information
- CAS
17049-49-9- Standard SMILES
[Br-].[CH2-]CCCCCCC.[Mg+2]- InChIKey
ZDUZWGUHIRQPGP-UHFFFAOYSA-M- Molecular formula
- C8H17BrMg
- Average molar mass
- 217.43 g/mol
- Monoisotopic mass
- 216.0364
Names & identifiers
- Preferred name
- Magnesium, bromooctyl-
- IUPAC
- magnesium;octane;bromide
- English name
- N-OCTYLMAGNESIUM BROMIDE
- Molecular formula
- C8H17BrMg
- Molecular weight
- 217.43
Names & synonyms
17049-49-9octylmagnesium bromideMagnesium, bromooctyl-Bromooctyl magnesiumDTXSID10884954RefChem:800650DTXCID001024370629-427-6n-Octylmagnesium Bromidemagnesium;octane;bromide1-octylmagnesium bromideBromidooctylmagnesium
Show more names
bromooctyl-magnesiun-OctylMagnesiuM BroMide octylmagnesium bromide solution(ca. 22% in Tetrahydrofuran, ca. 1Mol/L)n-Octylmagnesium bromide 2M solution in DEE
C8H17MgBrn-Octylmagnesium bromide, 1.0 M in THFOctylmagnesium bromide 1M in THFOctylmagnesium bromide 2M in diethyl ethern-Octylmagnesium Bromide (ca. 22% in Tetrahydrofuran, ca. 1mol/L)MFCD00191566n-octylmagnesiumbromideoctyl magnesium bromide
Database identifiers
- CAS
17049-49-9- PubChem CID
- 86923
- DTXSID
DTXSID10884954- EC Number
- 629-427-6
Properties
Computed structural properties
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 40.2
Physicochemical properties
- Boiling point
- 34.6 °C · 34.6 °C
- Density
- 0.961 g/mL · 0.961 g/mL at 25 °C
- Flash point
- 31 °F · −31 °F
- form
- Liquid
- color
- Yellow to brown
- InChI
- 1S/C8H17.BrH.Mg/c1-3-5-7-8-6-4-2;;/h1,3-8H2,2H3;1H;/q;;+1/p-1
- InChIKey
- ZDUZWGUHIRQPGP-UHFFFAOYSA-M
- SMILES
- CCCCCCCC[Mg]Br
- CAS DataBase Reference
- 17049 · 17049-49-9
- EPA Substance Registry System
- Magnesium, bromooctyl- (17049-49-9)
- UNSPSC Code
- 12352103 · 12352103
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 2 · GHS02,GHS05,GHS07,GHS08
- Signal word
- Danger
- Hazard statements
- 224 · H224-H250-H260-H302-H314-H336-H225-H335-H371-H372
- Precautionary statements
- 233 · P233-P240-P241+P242+P243-P260-P264-P270-P271-P280-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P308+P311-P403+P233-P405-P501-P210-P222-P223-P231+P232-P370+P378-P422
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
Danger
H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Corr. 1B (100%)
Safety data
- PPE
- Faceshields, Gloves, Goggles
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 3399 4.3/PG 1
- hs_code
- 2931900090
- risk_code
- 12-14/15-19-22-34-66-67-14
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS05,GHS07,GHS08
- hazard_code
- F+,C
- safety_code
- 26-36/37/39-43-45-16
- hazard_class
- 3/8
- Storage Class
- 4.3 - Hazardous materials which set free flammable gases upon contact with water
- packing_group
- II
- target organs
- Central nervous system
- Hazard statements
- H224-H250-H260-H302-H314-H336-H225-H335-H371-H372
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationMagnesium, bromooctyl-: INACTIVE
Applications
UsesN-OCTYLMAGNESIUM BROMIDE can be used as a Grignard reagent, which can undergo addition reactions with carbonyl groups to lengthen carbon chains or synthesize alcohols.
Upstream & downstream products
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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