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41270-80-8

41270-80-8 structural image
Product Name: methyl 2-(formylamino)benzoate
Formula: C9H9NO3
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Yellowish solid Fruity grape type aroma
Solubility Slightly soluble in water
Kovats Retention Index 1564.1

COMPUTED DESCRIPTORS

Molecular Weight 179.17 g/mol
XLogP3 1.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 179.058243149 g/mol
Monoisotopic Mass 179.058243149 g/mol
Topological Polar Surface Area 55.4 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 193
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-formylanthranilate is an amidobenzoic acid.