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1532-72-5,MFCD00006903
Catalog No.:AA00HY1A

1532-72-5 | Isoquinoline N-oxide

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
≥98%
in stock  
$17.00   $12.00
- +
5g
97%
in stock  
$25.00   $18.00
- +
100g
97%
in stock  
$392.00   $275.00
- +
500g
95%
in stock  
$1,556.00   $1,089.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00HY1A
Chemical Name:
Isoquinoline N-oxide
CAS Number:
1532-72-5
Molecular Formula:
C9H7NO
Molecular Weight:
145.1580
MDL Number:
MFCD00006903
SMILES:
[O-][n+]1ccc2c(c1)cccc2
NSC Number:
153684
Properties
Computed Properties
 
Complexity:
138  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
0  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
0.3  

Literature

Title: Calculating virtual log P in the alkane/water system (log P(N)(alk)) and its derived parameters deltalog P(N)(oct-alk) and log D(pH)(alk).

Journal: Journal of medicinal chemistry 20050505

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Tags:1532-72-5 Molecular Formula|1532-72-5 MDL|1532-72-5 SMILES|1532-72-5 Isoquinoline N-oxide
Catalog No.: AA00HY1A
1532-72-5,MFCD00006903
1532-72-5 | Isoquinoline N-oxide
Pack Size： 1g
Purity： ≥98%
in stock
$17.00 $12.00
Pack Size： 5g
Purity： 97%
in stock
$25.00 $18.00
Pack Size： 100g
Purity： 97%
in stock
$392.00 $275.00
Pack Size： 500g
Purity： 95%
in stock
$1,556.00 $1,089.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00HY1A
Chemical Name: Isoquinoline N-oxide
CAS Number: 1532-72-5
Molecular Formula: C9H7NO
Molecular Weight: 145.1580
MDL Number: MFCD00006903
SMILES: [O-][n+]1ccc2c(c1)cccc2
NSC Number: 153684
Properties
Complexity: 138  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 11  
Hydrogen Bond Acceptor Count: 1  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 0  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 0.3  
Literature fold

Title: Calculating virtual log P in the alkane/water system (log P(N)(alk)) and its derived parameters deltalog P(N)(oct-alk) and log D(pH)(alk).

Journal: Journal of medicinal chemistry20050505

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