1,2-Dimethoxyethane;[2,6-di(propan-2-yl)phenyl]imino-(2-methyl-2-phenylpropylidene)molybdenum(2+);bis(trifluoromethanesulfonate)
Basic information
- CAS
126949-63-1- Standard SMILES
CC(C)c1cccc(C(C)C)c1[N]=[Mo+2]=[CH]C(C)(C)c1ccccc1.COCCOC.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F- InChIKey
NLTJIWBSURFRCN-UHFFFAOYSA-L- Molecular formula
- C28H39F6MoNO8S2
- Average molar mass
- 791.7 g/mol
- Monoisotopic mass
- 793.107532
Names & identifiers
- Preferred name
- 1,2-Dimethoxyethane;[2,6-di(propan-2-yl)phenyl]imino-(2-methyl-2-phenylpropylidene)molybdenum(2+);bis(trifluoromethanesulfonate)
- IUPAC
- 1,2-dimethoxyethane;[2,6-di(propan-2-yl)phenyl]imino-(2-methyl-2-phenylpropylidene)molybdenum(2+);bis(trifluoromethanesulfonate)
- English name
- 2,6-DIISOPROPYLPHENYLIMIDO NEOPHYLIDENEMOLYBDENUM (VI) BIS(TRIFLUOROMETHANESULFONATE)DIMETHOXYETHANE ADDUCT
- Molecular formula
- C28H38F6MoNO8S2
- Molecular weight
- 790.67
Names & synonyms
126949-63-11,2-Dimethoxyethane;[2,6-di(propan-2-yl)phenyl]imino-(2-methyl-2-phenylpropylidene)molybdenum(2+);trifluoromethanesulfonateSCHEMBL215258322 6-DII-PROP.BENZOLAMINATO-DME-2-ME.-2PH[2,6-di(propan-2-yl)phenyl]imino-(2-methyl-2-phenylpropylidene)molybdenum(2+)2,6-DIISOPROPYLPHENYLIMIDO NEOPHYLIDENEMOLYBDENUM BIS(TRIFLUOROMETHANESULFONATE)DIMETHOXYETHANE ADDUCT(2,6-Diisopropylbenzenaminato)(1,2-dimethoxyethane)(2-methyl-2-phenylpropylidene)molybdenum di-triflate2,6-Diisopropylphenylimidoneophylidenemolybdenum(VI)bis(trifluoromethanesulfonate)dimethoxyethaneadduct(2,6-Diisopropylbenzenaminato)(1,2-dimethoxyethane)(2-methyl-2-phenylpropylidene)molybdenum di-triflate2,6-DIISOPROPYLPHENYLIMIDO NEOPHYLIDENEMOLYBDENUM (VI) BIS(TRIFLUOROMETHANESULFONATE)DIMETHOXYETHANE ADDUCT(2,6-Diisopropylanilinato)(2-methyl-2-phenylpropylidene)molybdenum 1,2-dimethoxyethane complex di-triflate
Database identifiers
- CAS
Properties
Computed structural properties
- Topological polar surface area
- 162 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 15
- Rotatable bonds
- 8
- Heavy atoms
- 46
- Formal charge
- 0
- Complexity
- 585
Physicochemical properties
- form
- Powder
- color
- yellow to orange
- Sensitive
- air sensitive, moisture sensitive, store cold
- CAS DataBase Reference
- 126949 · 126949-63-1
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H335-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
- Hazard Codes
- C
- Risk Statements
- 34 · 34
- Safety Statements
- 26 · 26-36/37/39-45
- RIDADR
- 1760 · UN 1760 8/PG 3
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
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Safety data
- ridadr
- UN 1760 8/PG 3
- risk_code
- 34
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- C
- safety_code
- 26-36/37/39-45
- Hazard statements
- H315-H335-H319
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Applications
UsesUsed as a starting material for preparations of various molybdenum metathesis catalysts.
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Related reactions
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Compound notes
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