Compound: METHYL ANTHRANILATE
SMILES: O=C(OC)c1c(N)cccc1
InChIKey: VAMXMNNIEUEQDV-UHFFFAOYSA-N
Synonyms: METHYL ANTHRANILATE, Methyl 2-aminobenzoate, 134-20-3, 2-Aminobenzoic acid methyl ester, Methyl o-aminobenzoate, Anthranilic acid methyl ester, o-Carbomethoxyaniline, 2-Carbomethoxyaniline, 2-(Methoxycarbonyl)aniline, Benzoic acid, 2-amino-, methyl ester, FEMA No. 2682, o-Aminobenzoic acid methyl ester, Methylester kyseliny anthranilove, DTXSID6025567, CHEBI:73244, 981I0C1E5W, NSC-3109, DTXCID105567, RefChem:157789, 205-132-4, Methylanthranilate, Anthranilic acid, methyl ester, O-methyl anthranilate, MFCD00007710, methyl antranilate, NSC 3109, o-Amino methyl benzoate, 2-Aminobenzoic acid-methyl ester, o-Aminobenzoic acid, methyl ester, 2-amino-benzoic acid methyl ester, Methyl ester of o-Aminobenzoic acid, Methyl 2-Aminobenzoate (Methyl Anthranilate), aniline, 2-methoxycarbonyl-, Amino methyl benzoate, o-, Benzoic acid, amino-, methyl ester, CAS-134-20-3, Methyl anthranilate (natural), CCRIS 1349, HSDB 1008, EINECS 205-132-4, Epa Pesticide Chemical Code 128725, BRN 0606965, Methylester kyseliny anthranilove [Czech], METHYL-2-AMINOBENZOATE, UNII-981I0C1E5W, AI3-01022, Methylanthranilate; Methyl 2-aminobenzoate; 2-Aminobenzoic acid methyl ester, FEMA 2682, Carbomethoxyaniline, 2-Aminobenzoic acid, methyl ester, methyl aminobenzoate, o-methoxycarbonylaniline, methyl 2-amino-benzoate, WLN: ZR BVO1, SCHEMBL57713, Methyl 2-aminobenzoate, 99%, orb1297285, orb3025344, SCHEMBL1196349, SCHEMBL3944522, SCHEMBL6070132, SCHEMBL6790765, SCHEMBL7006875, CHEMBL1493986, METHYL ANTHRANILATE [MI], SCHEMBL29444250, 2-Aminobenzoic-acid methyl ester, METHYL ANTHRANILATE [FCC], NSC3109, 2-amino benzoic acid methyl ester, METHYL ANTHRANILATE [FHFI], METHYL ANTHRANILATE [HSDB], METHYL ANTHRANILATE [VANDF], METHYL ANTHRANILATE [MART.], STR00871, Tox21_201657, Tox21_300347, BDBM50581836, METHYL ANTHRANILATE [WHO-DD], methyl ester of o-amino benzoic acid, SBB059788, STK045541, AKOS000119222, CS-W019645, FM01597, Methyl anthranilate, >=98%, FCC, FG, NCGC00091409-01, NCGC00091409-02, NCGC00091409-03, NCGC00254347-01, NCGC00259206-01, AC-11600, BENZOIC ACID METHYL ESTER,2-AMINO, HY-77342, Methyl-2-aminobenzoate;Methyl anthranilate, DB-042220, Methyl anthranilate, natural, >=99%, FG, A0500, NS00002018, ST45255311, C20634, D77860, Methyl 2-aminobenzoate, ReagentPlus(R), >=99%, Methyl anthranilate, natural (US), >=99%, FG, F225357, Q420894, F2141-0131, Methyl 2-aminobenzoate, Vetec(TM) reagent grade, 98%, InChI=1/C8H9NO2/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5H,9H2,1H
Theoretical properties:
molecular_formula: C8H9NO2
molecular_weight: 151.16 g/mol
exact_mass: 151.063328530 g/mol
formal_charge: 0
hydrogen_bond_donor_count: 1
hydrogen_bond_acceptor_count: 3
rotatable_bond_count: 2
heavy_atom_count: 11
topological_polar_surface_area: 52.3 Å²
isotope_atom_count: 0
covalently_bonded_unit_count: 1
Physical properties:
physical_state: Crystals
color: Crystals
odor: Grape-like odor
boiling_point: 493 °F at 760 mmHg (NTP, 1992)
melting_point: 75 to 77 °F (NTP, 1992)
density: 1.1682 at 50 °F (NTP, 1992) - Denser than water; will sink
solubility: Slightly soluble (NTP, 1992)
flash_point: 220 °F (NTP, 1992)
vapor_pressure: 0.02 [mmHg]
Descriptions:
pubchem: Methyl anthranilate is a benzoate ester that is the methyl ester of anthranilic acid. It has a role as a metabolite and a flavouring agent. It is functionally related to an anthranilic acid.
chebi: A benzoate ester that is the methyl ester of anthranilic acid.
chembl: METHYL ANTHRANILATE is a small molecule listed in the ChEMBL database but has not progressed to an approved clinical phase.
wikipedia: Methyl anthranilate, also known as MA, methyl 2-aminobenzoate, or carbomethoxyaniline, is an ester of anthranilic acid. Its chemical formula is C8H9NO2. It has a strong and fruity grape smell, and one of its key uses is as a flavoring agent.