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848819-82-9,MFCD08448276
Catalog No.:AA004W6O

848819-82-9 | Methyl 4-(cyclopropylamino)-3-nitrobenzoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$145.00   $102.00
- +
5g
97%
in stock  
$411.00   $288.00
- +
25g
97%
in stock  
$1,142.00 $799.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA004W6O
Chemical Name:
Methyl 4-(cyclopropylamino)-3-nitrobenzoate
CAS Number:
848819-82-9
Molecular Formula:
C11H12N2O4
Molecular Weight:
236.2240
MDL Number:
MFCD08448276
SMILES:
COC(=O)c1ccc(c(c1)[N+](=O)[O-])NC1CC1
Properties
Properties
 
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
311  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.7  

Downstream Synthesis Route

[1]Oezden,Seckin;Atabey,Dilek;Yildiz,Sulhiye;Goeker,Hakan[BioorganicandMedicinalChemistry,2005,vol.13,#5,p.1587-1597]

[2]Xu,Yu-Ling;Lin,Hong-Yan;Ruan,Xu;Yang,Sheng-Gang;Hao,Ge-Fei;Yang,Wen-Chao;Yang,Guang-Fu[EuropeanJournalofMedicinalChemistry,2015,vol.92,p.427-438]

[1]Oezden,Seckin;Atabey,Dilek;Yildiz,Sulhiye;Goeker,Hakan[BioorganicandMedicinalChemistry,2005,vol.13,#5,p.1587-1597]

[2]Xu,Yu-Ling;Lin,Hong-Yan;Ruan,Xu;Yang,Sheng-Gang;Hao,Ge-Fei;Yang,Wen-Chao;Yang,Guang-Fu[EuropeanJournalofMedicinalChemistry,2015,vol.92,p.427-438]

[1]Oezden,Seckin;Atabey,Dilek;Yildiz,Sulhiye;Goeker,Hakan[BioorganicandMedicinalChemistry,2005,vol.13,#5,p.1587-1597]

848819-82-9   
1-cyclopropyl-2-(pyridin-3-ylmethyl)-carbamoyl-methyl}-1<i>H</i>-benzoimidazole-5-carboxylicacidmethylester 

[1]Oezden,Seckin;Atabey,Dilek;Yildiz,Sulhiye;Goeker,Hakan[BioorganicandMedicinalChemistry,2005,vol.13,#5,p.1587-1597]

[1]Oezden,Seckin;Atabey,Dilek;Yildiz,Sulhiye;Goeker,Hakan[BioorganicandMedicinalChemistry,2005,vol.13,#5,p.1587-1597]

[2]Xu,Yu-Ling;Lin,Hong-Yan;Ruan,Xu;Yang,Sheng-Gang;Hao,Ge-Fei;Yang,Wen-Chao;Yang,Guang-Fu[EuropeanJournalofMedicinalChemistry,2015,vol.92,p.427-438]

Literature
Quotation Request
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SDS
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Tags:848819-82-9 Molecular Formula|848819-82-9 MDL|848819-82-9 SMILES|848819-82-9 Methyl 4-(cyclopropylamino)-3-nitrobenzoate
Catalog No.: AA004W6O
848819-82-9,MFCD08448276
848819-82-9 | Methyl 4-(cyclopropylamino)-3-nitrobenzoate
Pack Size： 1g
Purity： 97%
in stock
$145.00 $102.00
Pack Size： 5g
Purity： 97%
in stock
$411.00 $288.00
Pack Size： 25g
Purity： 97%
in stock
$1,142.00 $799.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA004W6O
Chemical Name: Methyl 4-(cyclopropylamino)-3-nitrobenzoate
CAS Number: 848819-82-9
Molecular Formula: C11H12N2O4
Molecular Weight: 236.2240
MDL Number: MFCD08448276
SMILES: COC(=O)c1ccc(c(c1)[N+](=O)[O-])NC1CC1
Properties
Storage: Keep in dry area;2-8℃;  
Complexity: 311  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 17  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.7  
Downstream Synthesis Route
848819-82-9    848819-84-1 

[1]Oezden,Seckin;Atabey,Dilek;Yildiz,Sulhiye;Goeker,Hakan[BioorganicandMedicinalChemistry,2005,vol.13,#5,p.1587-1597]

[2]Xu,Yu-Ling;Lin,Hong-Yan;Ruan,Xu;Yang,Sheng-Gang;Hao,Ge-Fei;Yang,Wen-Chao;Yang,Guang-Fu[EuropeanJournalofMedicinalChemistry,2015,vol.92,p.427-438]

14719-83-6    765-30-0    848819-82-9 

[1]Oezden,Seckin;Atabey,Dilek;Yildiz,Sulhiye;Goeker,Hakan[BioorganicandMedicinalChemistry,2005,vol.13,#5,p.1587-1597]

[2]Xu,Yu-Ling;Lin,Hong-Yan;Ruan,Xu;Yang,Sheng-Gang;Hao,Ge-Fei;Yang,Wen-Chao;Yang,Guang-Fu[EuropeanJournalofMedicinalChemistry,2015,vol.92,p.427-438]

848819-82-9    848819-90-9 

[1]Oezden,Seckin;Atabey,Dilek;Yildiz,Sulhiye;Goeker,Hakan[BioorganicandMedicinalChemistry,2005,vol.13,#5,p.1587-1597]

848819-82-9   
1-cyclopropyl-2-(pyridin-3-ylmethyl)-carbamoyl-methyl}-1<i>H</i>-benzoimidazole-5-carboxylicacidmethylester 

[1]Oezden,Seckin;Atabey,Dilek;Yildiz,Sulhiye;Goeker,Hakan[BioorganicandMedicinalChemistry,2005,vol.13,#5,p.1587-1597]

96-99-1    848819-82-9 

[1]Oezden,Seckin;Atabey,Dilek;Yildiz,Sulhiye;Goeker,Hakan[BioorganicandMedicinalChemistry,2005,vol.13,#5,p.1587-1597]

[2]Xu,Yu-Ling;Lin,Hong-Yan;Ruan,Xu;Yang,Sheng-Gang;Hao,Ge-Fei;Yang,Wen-Chao;Yang,Guang-Fu[EuropeanJournalofMedicinalChemistry,2015,vol.92,p.427-438]

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