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Home Fluorides 691868-96-9
691868-96-9,MFCD03102501
Catalog No.:AA00IPSP

691868-96-9 | 1-(4-methylphenyl)-3-[(3,4,4-trifluorobut-3-en-1-yl)sulfanyl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
>90%
1 week  
$299.00   $209.00
- +
5mg
>90%
1 week  
$319.00   $223.00
- +
10mg
>90%
1 week  
$358.00   $250.00
- +
500mg
>90%
1 week  
$1,087.00   $761.00
- +
1g
>90%
1 week  
$1,960.00   $1,372.00
- +
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Technical Information
Catalog Number:
AA00IPSP
Chemical Name:
1-(4-methylphenyl)-3-[(3,4,4-trifluorobut-3-en-1-yl)sulfanyl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
CAS Number:
691868-96-9
Molecular Formula:
C21H19F3N2S
Molecular Weight:
388.4492
MDL Number:
MFCD03102501
SMILES:
N#Cc1c(SCCC(=C(F)F)F)nc(c2c1CCCC2)c1ccc(cc1)C
Properties
Computed Properties
 
Complexity:
575  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
6  
Rotatable Bond Count:
5  
XLogP3:
5.9  

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Additional Info:
SDS
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Tags:691868-96-9 Molecular Formula|691868-96-9 MDL|691868-96-9 SMILES|691868-96-9 1-(4-methylphenyl)-3-[(3,4,4-trifluorobut-3-en-1-yl)sulfanyl]-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile