AG003RMT

404010-84-0 | Methyl 2-amino-4-morpholinobenzoate

AG003RMT

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CAS Number	404010-84-0
Catalog Number	AG003RMT(AGN-PC-0CL6UA)
Chemical Name	Methyl 2-amino-4-morpholinobenzoate
IUPAC Name	methyl 2-amino-4-morpholin-4-ylbenzoate
InChI	InChI=1S/C12H16N2O3/c1-16-12(15)10-3-2-9(8-11(10)13)14-4-6-17-7-5-14/h2-3,8H,4-7,13H2,1H3
InChI Key	XQTXHIWXBHFMRZ-UHFFFAOYSA-N
MDL Number	MFCD22192343
Molecular Formula	C12H16N2O3
Molecular Weight	236.2670
SMILES	O=C(OC)C1=CC=C(N2CCOCC2)C=C1N
Synonyms	Methyl 2-amino-4-morpholinobenzoate, 404010-84-0, methyl 2-amino-4-morpholin-4-ylbenzoate, Benzoic acid, 2-amino-4-(4-morpholinyl)-, methyl ester, SCHEMBL5054798, KS-00000BNU, XQTXHIWXBHFMRZ-UHFFFAOYSA-N, Methyl2-Amino-4-morpholinobenzoate, 6945AJ, MFCD22192343, ZINC90513446, AKOS022184156, TRA0015324, AS-32274, CJ-22589, DA-18229, SY019138, AJ-128863, AX8268484, TC-308433, FT-0755214, K-8633, MFCD22192343 (97+%), C12H16N2O3, 3167-49-5,

Complexity	267
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	236.116g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	236.271g/mol
Monoisotopic Mass	236.116g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	64.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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