85-91-6,MFCD00017183
Catalog No.:AA004QNN

85-91-6 | Methyl 2-(methylamino)benzoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
10g
98%
in stock  
$6.00   $4.00
- +
25g
98%
in stock  
$8.00   $6.00
- +
100g
98%
in stock  
$24.00   $17.00
- +
500g
98%
in stock  
$118.00   $83.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA004QNN
Chemical Name:
Methyl 2-(methylamino)benzoate
CAS Number:
85-91-6
Molecular Formula:
C9H11NO2
Molecular Weight:
165.1891
MDL Number:
MFCD00017183
SMILES:
COC(=O)c1ccccc1NC
NSC Number:
9406
FEMA Number:
2718
Properties
Properties
 
BP:
252.4±13.0°C at 760 mmHg  
Form:
Liquid  
MP:
17-19 °C(lit.);  
Refractive Index:
n20/D 1.579(lit.)  
Solubility:
Miscible in all proportions with ethanol 96%, DMSO and diethyl ether.  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
159  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.3  

Literature

Title: Characterisation of calamansi (Citrus microcarpa). Part I: volatiles, aromatic profiles and phenolic acids in the peel.

Journal: Food chemistry 20120915

Title: Identification of a new antinociceptive alkaloid isopropyl N-methylanthranilate from the essential oil of Choisya ternata Kunth.

Journal: Journal of ethnopharmacology 20110601

Title: Essential oil from Zanthoxylum tingoassuiba loaded into multilamellar liposomes useful as antimicrobial agents.

Journal: Journal of microencapsulation 20091201

Title: Inheritance of characters involved in fruit quality in a citrus interspecific allotetraploid somatic hybrid.

Journal: Journal of agricultural and food chemistry 20090610

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

Title: Volatile constituents of redblush grapefruit (Citrus paradisi) and pummelo (Citrus grandis) peel essential oils from Kenya.

Journal: Journal of agricultural and food chemistry 20051214

Title: Production of natural methyl anthranilate by microbial N-demethylation of N-methyl methyl anthranilate by the topsoil-isolated bacterium Bacillus megaterium.

Journal: Journal of agricultural and food chemistry 20051130

Title: Leaf volatile compounds of seven citrus somatic tetraploid hybrids sharing willow leaf mandarin (Citrus deliciosa Ten.) as their common parent.

Journal: Journal of agricultural and food chemistry 20030924

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SDS
Tags:85-91-6 Molecular Formula|85-91-6 MDL|85-91-6 SMILES|85-91-6 Methyl 2-(methylamino)benzoate
Catalog No.: AA004QNN
85-91-6,MFCD00017183
85-91-6 | Methyl 2-(methylamino)benzoate
Pack Size: 10g
Purity: 98%
in stock
$6.00 $4.00
Pack Size: 25g
Purity: 98%
in stock
$8.00 $6.00
Pack Size: 100g
Purity: 98%
in stock
$24.00 $17.00
Pack Size: 500g
Purity: 98%
in stock
$118.00 $83.00
Quantity
- +
Add to Card
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bulk Quotation Request
Technical Information
Catalog Number: AA004QNN
Chemical Name: Methyl 2-(methylamino)benzoate
CAS Number: 85-91-6
Molecular Formula: C9H11NO2
Molecular Weight: 165.1891
MDL Number: MFCD00017183
SMILES: COC(=O)c1ccccc1NC
NSC Number: 9406
FEMA Number: 2718
Properties
BP: 252.4±13.0°C at 760 mmHg  
Form: Liquid  
MP: 17-19 °C(lit.);  
Refractive Index: n20/D 1.579(lit.)  
Solubility: Miscible in all proportions with ethanol 96%, DMSO and diethyl ether.  
Storage: Inert atmosphere;Room Temperature;  
Complexity: 159  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 12  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.3  
Literature fold

Title: Characterisation of calamansi (Citrus microcarpa). Part I: volatiles, aromatic profiles and phenolic acids in the peel.

Journal: Food chemistry20120915

Title: Identification of a new antinociceptive alkaloid isopropyl N-methylanthranilate from the essential oil of Choisya ternata Kunth.

Journal: Journal of ethnopharmacology20110601

Title: Essential oil from Zanthoxylum tingoassuiba loaded into multilamellar liposomes useful as antimicrobial agents.

Journal: Journal of microencapsulation20091201

Title: Inheritance of characters involved in fruit quality in a citrus interspecific allotetraploid somatic hybrid.

Journal: Journal of agricultural and food chemistry20090610

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology20060501

Title: Volatile constituents of redblush grapefruit (Citrus paradisi) and pummelo (Citrus grandis) peel essential oils from Kenya.

Journal: Journal of agricultural and food chemistry20051214

Title: Production of natural methyl anthranilate by microbial N-demethylation of N-methyl methyl anthranilate by the topsoil-isolated bacterium Bacillus megaterium.

Journal: Journal of agricultural and food chemistry20051130

Title: Leaf volatile compounds of seven citrus somatic tetraploid hybrids sharing willow leaf mandarin (Citrus deliciosa Ten.) as their common parent.

Journal: Journal of agricultural and food chemistry20030924

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