Basic information
- CAS
1271-51-8- Standard SMILES
C=Cc1cc[cH-]c1.[Fe+2].c1cc[cH-]c1- InChIKey
VGBAECKRTWHKHC-UHFFFAOYSA-N- Molecular formula
- C12H12Fe
- Average molar mass
- 212.07 g/mol
- Monoisotopic mass
- 212.028836
Names & identifiers
- Preferred name
- Ferrocene, ethenyl-
- IUPAC
- cyclopenta-1,3-diene;2-ethenylcyclopenta-1,3-diene;iron(2+)
- English name
- Vinylferrocene
- Molecular formula
- C12H12Fe10*
- Molecular weight
- 212.07
Names & synonyms
Ferrocene, ethenyl-cyclopenta-1,3-diene;2-ethenylcyclopenta-1,3-diene;iron(2+)VFCEINECS 215-041-1SCHEMBL29518300SCHEMBL30787830VGBAECKRTWHKHC-UHFFFAOYSA-NMFCD30580682AKOS028109484ferrous;cyclopenta-1,3-diene;1-vinylcyclopenta-1,3-dienecyclopenta-1,3-diene;1-ethenylcyclopenta-1,3-diene;iron(2+)VINYLFERROCENE
Show more names
Vinylferrocene CASVinylferrocene,98%Vinylferrocene 97%Vinylferrocene,99%Vinylferrocene ,97%Vinylferroceneorangextl1-ethenylcyclopenta-1,3-dieneVinylferrocene ISO 9001：2015 REACH
Database identifiers
- CAS
1271-51-8- PubChem CID
- 79155
Properties
Computed structural properties
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 70
Physicochemical properties
- Melting point
- 51 · 51-53 °C (lit.)
- Boiling point
- 80 · 80-85 °C/0.2 mmHg (lit.)
- Flash point
- 144 °F · 144 °F
- storage temp.
- 2 · Sealed in dry,2-8°C
- form
- crystal
- color
- orange
- Water Solubility
- Insoluble in water.
- Hydrolytic Sensitivity
- 4 · 4: no reaction with water under neutral conditions
- Exposure limits
- 1 mg/m3NIOSH: · ACGIH: TWA 1 mg/m3NIOSH: TWA 1 mg/m3
- Stability
- Stable. Highly flammable. Incompatible with strong acids, strong oxidizing agents.
- InChI
- InChI=1S/C7H7.C5H5.Fe/c1-2-7-5-3-4-6-7;1-2-4-5-3-1;/h2-6H,1H2;1-5H;
- InChIKey
- LCPVTGDQYVLJHU-UHFFFAOYSA-N
- SMILES
- [C]1(C=C)[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Fe] |^1:0,3,4,5,6,7,8,9,10,11|
- NIST Chemistry Reference
- Vinylferrocene(1271-51-8)
- UNSPSC Code
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- F
- 10
- PPE
- Eyeshields, Gloves, type P3 (EN 143) respirator cartridges
- wgk
- 3
- tsca
- No
- ridadr
- UN 1325 4.1/PG 2
- hs_code
- 29319090
- risk_code
- 11-22
- Signal word
- Danger
- Symbol(GHS)
- GHS02
- hazard_code
- F
- safety_code
- 16-22-24/25-7/9-33
- hazard_class
- 4.1
- Storage Class
- 4.1B - Flammable solid hazardous materials
- packing_group
- II
- Hazard statements
- H228
- Limited Quantities
- 1.0 Kg (2.2 lbs)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
- Hazard Classifications
- Flam. Sol. 1
- Precautionary statements
- P210
Chemistry & industry
Applications
UsesUsed in the synthesis of 2-aminomethylferrocenes from vinyl ferrocene and lithium amides.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers100 total
国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
山东春雨精细化工有限责任公司13561220159 · [email protected]
湖北昔少年生物科技有限公司0711-3700636 18827410479 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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