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85-91-6

85-91-6 structural image
Product Name: Methyl 2-(methylamino)benzoate
Formula: C9H11NO2
Synonyms: Methyl N-methylanthranilate
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Colorless or pale yellow liquid with an odor of grapes; [Hawley] Pale-yellow liquid with a slightly blue fluorescence or solid; Odor like orange peels; mp = 18.5-19.5 deg C; [HSDB]
Color/Form PALE-YELLOW LIQ WITH SLIGHT BLUISH FLUORESCENCE
Odor ORANGE & MANDARIN-PEEL-LIKE ODOR
Taste MUSTY, GRAPE-LIKE FLAVOR, SOMEWHAT MORE BERRY-LIKE THAN GRAPE
Boiling Point 256 °C @ 760 MM HG
Melting Point 18.5-19.5 °C
Flash Point 91 °C
Solubility INSOL IN WATER; SOL IN ALCOHOL, ETHER
Density 1.120 @ 15 °C
Refractive Index INDEX OF REFRACTION: 1.5785-1.5810 (1.5800-1.5810) @ 20 °C
Kovats Retention Index 1376 1375 1385 1385 1385 1389 1385 1388
Other Experimental Properties CONGEALING POINT: GREATER THAN 12.0 °C (12.5-15.5 °C)
Chemical Classes Other Classes -> Benzoic Acid Derivatives

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H319:Serious eye damage/eye irritation
Precautionary Statement Codes P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
P337+P313:IF eye irritation persists: Get medical advice/attention.

COMPUTED DESCRIPTORS

Molecular Weight 165.19 g/mol
XLogP3 2.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 165.078978594 g/mol
Monoisotopic Mass 165.078978594 g/mol
Topological Polar Surface Area 38.3 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 159
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Methyl N-methylanthranilate is a methyl ester resulting from the formal condensation of the carboxy group of N-methylanthranilic acid with methanol. It has a role as a fungal metabolite, a plant metabolite and an animal metabolite. It is a benzoate ester, a methyl ester, a secondary amino compound and a substituted aniline. It is functionally related to a N-methylanthranilic acid.

RELATED SUPPLIERS

HJ AROCHEM

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product:DI METHYL ANTHRANILATE 85-91-6 99%

Anshul Specialty Molecules Pvt. Ltd

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product:85-91-6 Methyl N-methylanthranilate 98%
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