AG003RME

5035-82-5 | Methyl 2-amino-3,4,5-trimethoxybenzoate

AG003RME

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CAS Number	5035-82-5
Catalog Number	AG003RME(AGN-PC-0JLRK8)
Chemical Name	Methyl 2-amino-3,4,5-trimethoxybenzoate
EC Number	225-728-8
IUPAC Name	methyl 2-amino-3,4,5-trimethoxybenzoate
InChI	InChI=1S/C11H15NO5/c1-14-7-5-6(11(13)17-4)8(12)10(16-3)9(7)15-2/h5H,12H2,1-4H3
InChI Key	UPVUQELOASQBMY-UHFFFAOYSA-N
MDL Number	MFCD00008426
Molecular Formula	C11H15NO5
Molecular Weight	241.2405
NSC Number	80816
SMILES	O=C(OC)C1=CC(OC)=C(OC)C(OC)=C1N
Synonyms	Methyl 2-amino-3,4,5-trimethoxybenzoate, 5035-82-5, Methyl 3,4,5-trimethoxyanthranilate, UPVUQELOASQBMY-UHFFFAOYSA-N, Benzoic acid, 2-amino-3,4,5-trimethoxy-, methyl ester, 2-amino-3,4,5-trimethoxyBenzoic acid methyl ester, NSC80816, EINECS 225-728-8, ACMC-20akit, AC1L2VUV, Maybridge1_001467, Oprea1_505329, MLS000035980, AC1Q42H7, AC1Q5Z62, SCHEMBL4734795, CHEMBL1561823, CTK4J2507, HMS545K15, KS-00002BKL, ZINC28446, DTXSID70198408, HMS2336H18, ALBB-014365, 4398AE, BBL037221, CM-138, MFCD00008426, NSC-80816, SBB000807, STK865517, AKOS000120805, MCULE-5212293481, AJ-08476, SMR000062595, ST041017, TS-00719, ZB000831, DB-071178, Methyl 3,4,5-trimethoxyanthranilate, 99%, TC-166268, AM20040575, FT-0628432, R1200, EN300-17242, AB00414604-08, 035M825, SR-01000510943, Anthranilic acid, 3,4,5-trimethoxy-, methyl ester, I01-8640, I01-8652, SR-01000510943-1, Benzoic acid,2-amino-3,4,5-trimethoxy-, methyl ester, A0776/0036303, InChI=1/C11H15NO5/c1-14-7-5-6(11(13)17-4)8(12)10(16-3)9(7)15-2/h5H,12H2,1-4H, C11H15NO5, CID78735, AR-1J4663, C11-H15-N-O5, Methyl2-amino-3,4,5-trimethoxybenzoate, 52042-99-6,

Complexity	260
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	241.095g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	241.243g/mol
Monoisotopic Mass	241.095g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	80A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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