761388-52-7,MFCD22421483
Catalog No.:AA00G9K7

761388-52-7 | 3-(Isopropylamino)-4-nitrobenzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$226.00   $158.00
- +
5g
97%
in stock  
$837.00 $586.00
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00G9K7
Chemical Name:
3-(Isopropylamino)-4-nitrobenzoic acid
CAS Number:
761388-52-7
Molecular Formula:
C10H12N2O4
Molecular Weight:
224.2133
MDL Number:
MFCD22421483
SMILES:
CC(Nc1cc(ccc1[N+](=O)[O-])C(=O)O)C
Properties
Computed Properties
 
Complexity:
275  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.1  

Literature
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SDS
Tags:761388-52-7 Molecular Formula|761388-52-7 MDL|761388-52-7 SMILES|761388-52-7 3-(Isopropylamino)-4-nitrobenzoic acid
Catalog No.: AA00G9K7
761388-52-7,MFCD22421483
761388-52-7 | 3-(Isopropylamino)-4-nitrobenzoic acid
Pack Size: 1g
Purity: 97%
in stock
$226.00 $158.00
Pack Size: 5g
Purity: 97%
in stock
$837.00 $586.00
Quantity
- +
Add to Card
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bulk Quotation Request
Technical Information
Catalog Number: AA00G9K7
Chemical Name: 3-(Isopropylamino)-4-nitrobenzoic acid
CAS Number: 761388-52-7
Molecular Formula: C10H12N2O4
Molecular Weight: 224.2133
MDL Number: MFCD22421483
SMILES: CC(Nc1cc(ccc1[N+](=O)[O-])C(=O)O)C
Properties
Complexity: 275  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 16  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.1  
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