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170856-55-0,MFCD16659874
Catalog No.:AA00AMGF

170856-55-0 | Ethyl 2-(isochroman-1-yl)acetate

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1g
97%
2 weeks  
$958.00   $670.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00AMGF
Chemical Name:
Ethyl 2-(isochroman-1-yl)acetate
CAS Number:
170856-55-0
Molecular Formula:
C13H16O3
Molecular Weight:
220.2643
MDL Number:
MFCD16659874
SMILES:
CCOC(=O)CC1OCCc2c1cccc2
Properties
Computed Properties
 
Complexity:
239  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
1  
XLogP3:
1.8  

Downstream Synthesis Route

[1]TenBrink;Bergh;Duncan;Harris;Huff;Lahti;Lawson;Lutzke;Martin;Rees;Schlachter;Sih;Smith[JournalofMedicinalChemistry,1996,vol.39,#13,p.2435-2437]

Literature
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SDS
Tags:170856-55-0 Molecular Formula|170856-55-0 MDL|170856-55-0 SMILES|170856-55-0 Ethyl 2-(isochroman-1-yl)acetate