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12671-74-8,MFCD00144314
Catalog No.:AA000T1U

12671-74-8 | 2-Octadecyl-1H-thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
in stock  
$245.00   $172.00
- +
  • Technical Information
  • Properties
  • Literature
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  • Download SDS
Technical Information
Catalog Number:
AA000T1U
Chemical Name:
2-Octadecyl-1H-thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione
CAS Number:
12671-74-8
Molecular Formula:
C36H61NO2S
Molecular Weight:
571.9400
MDL Number:
MFCD00144314
SMILES:
CCCCCCCCCCCCCCCCCCn1c(=O)c2ccc3c4c2c(c1=O)ccc4c1c(s3)cccc1
Properties
Computed Properties
 
Complexity:
800  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
40  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
17  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
12.8  

Literature
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SDS
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Tags:12671-74-8 Molecular Formula|12671-74-8 MDL|12671-74-8 SMILES|12671-74-8 2-Octadecyl-1H-thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione
Catalog No.: AA000T1U
12671-74-8,MFCD00144314
12671-74-8 | 2-Octadecyl-1H-thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione
Pack Size： 1g
Purity：
in stock
$245.00 $172.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA000T1U
Chemical Name: 2-Octadecyl-1H-thioxantheno[2,1,9-def]isoquinoline-1,3(2H)-dione
CAS Number: 12671-74-8
Molecular Formula: C36H61NO2S
Molecular Weight: 571.9400
MDL Number: MFCD00144314
SMILES: CCCCCCCCCCCCCCCCCCn1c(=O)c2ccc3c4c2c(c1=O)ccc4c1c(s3)cccc1
Properties
Complexity: 800  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 40  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 17  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 12.8  
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