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712-25-4

Octahydro-3,6,1-(ethane[1,1,2]triyl)cyclobuta[cd]indene-2,8(1H)-dione is a complex organic compound with a molecular formula of C13H18O2. It is a cyclic structure with a cyclobuta[cd]indene core, which is a type of aromatic hydrocarbon. The compound is characterized by its octahydro (eight hydrogen atoms) and ethane[1,1,2]triyl (a three-carbon chain) components, which contribute to its unique structure and properties. This chemical is not commonly found in nature and is typically synthesized for specific applications in the fields of organic chemistry and pharmaceuticals. Its exact uses and properties depend on the context in which it is being studied or applied, but it represents an example of the vast diversity of organic compounds that can be created through chemical synthesis.

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  • 712-25-4 Structure

  • Basic information

    1. Product Name: octahydro-3,6,1-(ethane[1,1,2]triyl)cyclobuta[cd]indene-2,8(1H)-dione
    2. Synonyms:
    3. CAS NO:712-25-4
    4. Molecular Formula: C12H12O2
    5. Molecular Weight: 188.2225
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 712-25-4.mol

  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 352.7°C at 760 mmHg
    3. Flash Point: 132.3°C
    4. Appearance: N/A
    5. Density: 1.448g/cm3
    6. Vapor Pressure: 3.77E-05mmHg at 25°C
    7. Refractive Index: 1.657
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: octahydro-3,6,1-(ethane[1,1,2]triyl)cyclobuta[cd]indene-2,8(1H)-dione(CAS DataBase Reference)
    11. NIST Chemistry Reference: octahydro-3,6,1-(ethane[1,1,2]triyl)cyclobuta[cd]indene-2,8(1H)-dione(712-25-4)
    12. EPA Substance Registry System: octahydro-3,6,1-(ethane[1,1,2]triyl)cyclobuta[cd]indene-2,8(1H)-dione(712-25-4)

  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 712-25-4(Hazardous Substances Data)

712-25-4 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 712-25-4 includes 6 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 3 digits, 7,1 and 2 respectively; the second part has 2 digits, 2 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 712-25:
(5*7)+(4*1)+(3*2)+(2*2)+(1*5)=54
54 % 10 = 4
So 712-25-4 is a valid CAS Registry Number.

712-25-4SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name 712-25-4

1.2 Other means of identification

Product number -
Other names Pentacyclo<6.2.2.02,7.04,10.05,9>dodecan-3,6-dion

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:712-25-4 SDS

712-25-4Relevant articles and documents

The clemmensen reduction of pentacyclo [6.4.0.02,7.03,11.0 6,10]dodecane-9,12-dione

Martins,Fourie,Venter,Wessels

, p. 623 - 632 (1990)

The Clemmensen reduction of pentacyclo[6.4.0.02,7.03,11.0 6,10]= dodecane-9,12-dione unexpectedly led to the formation of pentacyclo[6.4.0. 02,6.05,9.04, 12]-2-dodecanol and pentacyclo[6.4.0.02,7.03,11.0 6,10]dode= cane-1,8-diol as main products. Tetracyclo[6.4.0.05,9.0412dodecane-2,7-dione and its corresponding hemiacetal were obtained as byproduc structures of the Clemmensen products were elucidated from an extensive 1H and 13C n.m.r. study.

The influence of hydrate formation on the Clemmensen reduction of pentacyclo [5.4.0.02,6;03,10;05,9]undecane-8,11-dione and pentacyclo[6.4.0.02,7.03,11.06,10]dodecane-9,

Martins,Viljoen,Coetzee,Fourie,Wessels

, p. 9215 - 9224 (2007/10/02)

Hydration of pentacyclo [5.4.0.02,6,03,10.05,9]undecane-8,11-dione led to the formation of a mixture of a geminal diol (80%) and a transannular hydrate (20%) and not to only the latter as previously accepted. Compounds with smaller intercarbonylic distances formed only transannular hydrates which promoted rearrangement reactions during Clemmensen reduction. The transannular hydrate of pentacyclo [6.4.0.02,7.03,11.06,10]dodecane-9,12-dione produced pentacyclo [6.4.0.02,6.05,9.04,12]-2-dodecanol.

Barriers to Intramolecular Hydride Transfers in Some Polycyclic Hydroxyketones

Craze, Gabrielle-Anne,Watt, Ian

, p. 175 - 184 (2007/10/02)

The hydroxyketones (1) and (2) have been prepared from the Diels-Alder adducts of p-benzoquinone with cyclopentadiene and cyclohexa-1,3-diene.The boron trifluoride-ether catalysed reaction of cyclohepta-1,3-diene with p-benzoquinone gave good yields of the Diels-Alder adduct which was converted into hydroxyketone (3).Experiments with cyclohexanol and admantan-2-ol established characteristic 13C n.m.r. chemical shifts associated with deprotonation of alcohols by dimsyl sodium in dimethyl sulphoxide.Solutions of the sodium salts of (1)-(3) were prepared and dynamic 13C n.m.r. spectroscopy gave barriers for their degenerate rearrangement of >21.7 (100 deg C), 19.0 (100 deg C), and 17.3 (72 deg C) kcal mol-1, respectively.The relationship between variation of barrier and molecular geometry is discussed with the aid of empirical force field calculations.

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