Basic information
- CAS
693-04-9- Standard SMILES
[CH2-]CCC.[Cl-].[Mg+2]- InChIKey
UUNGXYVLXYGZKH-UHFFFAOYSA-M- Molecular formula
- C4H9ClMg
- Average molar mass
- 116.87 g/mol
Overview
See also: Butylmagnesium chloride (annotation moved to).
Names & identifiers
- Preferred name
- Butylmagnesium chloride
- IUPAC
- magnesium;butane;chloride
- English name
- Butylmagnesium chloride
- Molecular formula
- C4H9ClMg
- Molecular weight
- 116.87
Names & synonyms
Butylmagnesium chloride693-04-9Magnesium, butylchloro-BuMgClMFCD00000475nBuMgClButylchloromagnesium; Butylmagnesiumm chloride; n-Butylmagnesium chloridebutylmagnesiumchloriden-butylmagnesiumchloriden-butylmagnesium chlorideEINECS 211-739-5UNII-4J83FGW852
Show more names
Butylmagnesiumn-Butylmagnesium chloride 2M solution in DEEButylchloromagnesiumButylMagnesiuM chlorButyl(chloro)magnesiumButylMagnesiuM Chloride Butylmagnesium chloride (6CI)
n-BuMgClButylchloridomagnesiumbutyl magnesium chloridebutyl-magnesium chloriden-butyl magnesium chloride1-butyl magnesium chlorideEC 211-739-5SCHEMBL5340
Database identifiers
- CAS
693-04-9- PubChem CID
- 101837
- DTXSID
DTXSID0074924
Properties
Computed structural properties
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 11.5
Physicochemical properties
- Melting point
- -17 °C · -17°C
- Boiling point
- 66 °C · 66°C
- Density
- 0.962 g/mL · 0.962 g/mL at 25 °C
- Flash point
- 115 °F · 115 °F
- storage temp.
- 2 · 2-8°C
- form
- Solution
- color
- Green-brown to brown
- Water Solubility
- reacts
- Sensitive
- Air & Moisture Sensitive
- BRN
- 3587228 · 3587228
- InChI
- InChI=1S/C4H9.ClH.Mg/c1-3-4-2;;/h1,3-4H2,2H3;1H;/q;;+1/p-1
- InChIKey
- UUNGXYVLXYGZKH-UHFFFAOYSA-M
- SMILES
- C(CC)C[Mg]Cl
- CAS DataBase Reference
- 693 · 693-04-9(CAS DataBase Reference)
- FDA UNII
- 4 J83FGW852 · 4J83FGW852
- EPA Substance Registry System
- Magnesium, butylchloro- (693-04-9)
- UNSPSC Code
Safety & regulation
Safety data
- F
- 10
- PPE
- Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
- wgk
- 1
- tsca
- TSCA listed
- ridadr
- UN 3399 4.3/PG 2
- hs_code
- 29319090
- risk_code
- 12-14/15-19-22-34-67-65-63-48/20-11-15-14-10-40-37
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS05,GHS07,GHS08
- hazard_code
- C,F,F+
- safety_code
- 7-9-16-26-29-33-36/37/39-43-45-62-46
- hazard_class
- 4.3
- 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
- H250-H260-H302-H314-H336-H226-H225-H335-H351-H371-H372-H261-H303-H318-H333
- Excepted Quantities
- Not Permitted as Excepted Quantity
- REACH Registrations
- Active
- Hazard Classifications
- Acute Tox. 4 OralEye Dam. 1Skin Corr. 1BSTOT SE 3Water-react 1
- Precautionary statements
- P303+P361+P353-P405-P501a-P222-P223-P231+P232-P261-P370+P378-P422-P280-P210-P305+P351+P338-P233-P240-P241+P242+P243-P260-P264-P270-P271-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P308+P311-P335+P334-P402+P404
Chemistry & industry
Applications
Usesn-Butylmagnesium chloride is used in organic synthesis, pharmaceuticals, agrochemicals and dyestuffs.
UsesButylmagnesium chloride (BuMgCl) is a Grignard reagent that can be used:To prevent the formation of passivating surface films on Mg electrodes.For the synthesis of lithium tributylmagnesate complex (n-Bu3MgLi) by reacting with n-BuLi.
Upstream & downstream products
Downstream products
Suppliers100 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
山东旭晨化工科技有限公司0533-15715337262 15715337262 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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