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97804-50-7,MFCD29044886
Catalog No.:AA00IJWR

97804-50-7 | (1R,4S,4Ar,9as)-rel-4a-methyl-1,4,4a,9a-tetrahydro-1,4-methanoanthracene-9,10-dione

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$7.00   $5.00
- +
1g
97%
in stock  
$16.00   $11.00
- +
5g
97%
in stock  
$53.00   $37.00
- +
10g
97%
in stock  
$76.00   $54.00
- +
25g
97%
in stock  
$92.00   $64.00
- +
100g
97%
in stock  
$295.00   $206.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00IJWR
Chemical Name:
(1R,4S,4Ar,9as)-rel-4a-methyl-1,4,4a,9a-tetrahydro-1,4-methanoanthracene-9,10-dione
CAS Number:
97804-50-7
Molecular Formula:
C16H14O2
Molecular Weight:
238.2812
MDL Number:
MFCD29044886
SMILES:
O=C1c2ccccc2C(=O)[C@]2([C@@H]1[C@H]1C=C[C@@H]2C1)C
Properties
Computed Properties
 
Complexity:
464  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
4  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
XLogP3:
2.6  

Upstream Synthesis Route

[1]SyntheticCommunications,2003,vol.33,#5,p.763-772

[2]SyntheticCommunications,1988,vol.18,#6,p.567-574

[3]IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,1996,vol.35,#4,p.303-311

[4]Tetrahedron,1992,vol.48,#9,p.1667-1674

[5]Patent:US2018/92863,2018,A1,.Locationinpatent:Paragraph0122

[1]AngewandteChemie-InternationalEdition,2009,vol.48,#2,p.370-374

[2]Chemistry-AEuropeanJournal,2010,vol.16,#12,p.3707-3719

[1]AngewandteChemie,1995,vol.107,#19,p.2333-2336

Downstream Synthesis Route

[1]JournaloftheChemicalSociety.Chemicalcommunications,1990,p.1505-1506

[1]Tetrahedron,1992,vol.48,p.1667-1674

[2]JournalofPhysicalOrganicChemistry,2005,vol.18,p.725-736

[1]SyntheticCommunications,2003,vol.33,p.763-772

[2]SyntheticCommunications,1988,vol.18,p.567-574

[3]IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,1996,vol.35,p.303-311

[4]Tetrahedron,1992,vol.48,p.1667-1674

[5]Patent:US2018/92863,2018,A1.Locationinpatent:Paragraph0122

58-27-5    542-92-7    97804-50-7   
C16H14O2 

[1]AngewandteChemie,1995,vol.107,p.2333-2336

97804-50-7    4444-13-7   
vitaminK 

[1]SyntheticCommunications,2003,vol.33,p.763-772

Literature
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SDS
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Tags:97804-50-7 Molecular Formula|97804-50-7 MDL|97804-50-7 SMILES|97804-50-7 (1R,4S,4Ar,9as)-rel-4a-methyl-1,4,4a,9a-tetrahydro-1,4-methanoanthracene-9,10-dione