Basic information
- CAS
1273-86-5- Standard SMILES
OC[c-]1[c-][c-][c-][c-]1.[Fe].[c-]1[c-][c-][cH-][c-]1- InChIKey
AUSGRYADILZTOF-UHFFFAOYSA-N- Molecular formula
- C11H4FeO-10
- Average molar mass
- 207.99 g/mol
- Monoisotopic mass
- 207.96115
Names & identifiers
- Preferred name
- Cyclopenta-1,3-diene;cyclopenta-2,4-dien-1-ylmethanol;iron
- IUPAC
- cyclopenta-1,3-diene;cyclopenta-2,4-dien-1-ylmethanol;iron
- English name
- Ferrocenemethanol
- Molecular formula
- C11H12FeO10*
- Molecular weight
- 216.06
Names & synonyms
NSC176246NSC-176246HYDROXYMETHYLFERROCENENSC 176246FERROCENEMETHANOLFERROCENYLMETHANOLFerrocenylcarbinolFerrocenemethanol,97%Ferrocenemethanol 97%Ferrocenemethanol,>98%Ferrocenemethanol (8CI)Hydroxymethylferrocene>
Database identifiers
- CAS
1273-86-5- PubChem CID
- 425792
Properties
Computed structural properties
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- -10
- Complexity
- 204
Physicochemical properties
- Melting point
- 79 · 79-81 °C (lit.)
- storage temp.
- Inert atmosphere,Room Temperature
- form
- crystal
- color
- yellow
- Water Solubility
- It is Soluble in water (partly miscible), and methanol.
- Sensitive
- Moisture Sensitive
- InChI
- InChI=1S/C6H7O.C5H5.Fe/c7-5-6-3-1-2-4-6;1-2-4-5-3-1;/h1-4,7H,5H2;1-5H;
- InChIKey
- QETISSZVCNFQBN-UHFFFAOYSA-N
- SMILES
- [C]1(CO)[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Fe] |^1:0,3,4,5,6,7,8,9,10,11|
- UNSPSC Code
- 12161600 · 12161600
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
- PPE
- 95 · Eyeshields, Gloves, type N95 (US)
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
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- hs_code
- 29319090
- risk_code
- 36/37/38-22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 37/39-26
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Applications
UsesFerrocenemethanol (FcMeOH) is commonly used as a water soluble ferrocene based reference redox system in electrochemical studies.It is used in the synthesis of ferrocenylmethoxy-isatins, potent antiproliferative agents.FcMeOH can be employed in the preparation of ferrocene-carbohydrate conjugates for biosensing applications.
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]
INTATRADE GmbH+49 3493/605464 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海弘顺生物科技有限公司15901914505 · [email protected]
韶远科技（上海）有限公司4000665055 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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