AG003V36

330680-46-1 | Trimethyl [2,2':6',2''-terpyridine]-4,4',4''-tricarboxylate

AG003V36

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CAS Number	330680-46-1
Catalog Number	AG003V36(AGN-PC-0H5U44)
Chemical Name	Trimethyl [2,2':6',2''-terpyridine]-4,4',4''-tricarboxylate
IUPAC Name	methyl 2,6-bis(4-methoxycarbonylpyridin-2-yl)pyridine-4-carboxylate
InChI	InChI=1S/C21H17N3O6/c1-28-19(25)12-4-6-22-15(8-12)17-10-14(21(27)30-3)11-18(24-17)16-9-13(5-7-23-16)20(26)29-2/h4-11H,1-3H3
InChI Key	YDXTYOYBYASPDS-UHFFFAOYSA-N
MDL Number	MFCD11042545
Molecular Formula	C21H17N3O6
Molecular Weight	407.3762
SMILES	COC(=O)C1=CC(=NC=C1)C1=NC(=CC(=C1)C(=O)OC)C1=CC(=CC=N1)C(=O)OC
Synonyms	330680-46-1, Trimethyl [2,2':6',2''-terpyridine]-4,4',4''-tricarboxylate, Trimethyl 2,2':6',2''-terpyridine-4,4',4''-tricarboxylate, AK103761, Trimethyl 2,2':6',2"-terpyridine-4,4',4"-tricarboxylate, TRIMETHYL 2,2',6',2"-TERPYRIDINE-4,4',4"-TRICARBOXYLATE, TRIMETHYL 2,2', SCHEMBL714108, EOS233, CTK8C0326, KS-00000QDR, DTXSID10735750, Trimethyl 2,2':6',2''-terpyridine-4,4',4''- tricarboxylate, ANW-64504, CT-134, MFCD11042545, ZINC35654095, AKOS016006270, CS-W004603, DS-4181, AJ-92046, SC-26152, SY056121, AB0077715, AX8235300, RT-016130, MFCD11042545 (95%), J-019002, Trimethyl 2,2':6',2-terpyridine-4,4',4-tricarboxylate, 4,4',4''-Tris(methoxycarbonyl)-2,2':6',2''-terpyridine, TRIMETHYL 2,2:6,2-TERPYRIDINE-4,4,4-TRICARBOXYLATE, methyl 2,6-bis(4-methoxycarbonylpyridin-2-yl)pyridine-4-carboxylate, Trimethyl 2,2':6',2"-terpyridine-4,4',4"-tricarboxylate, 98%, 2,2':6',2''-Terpyridine-4,4',4''-tricarboxylic Acid Trimethyl Ester, Trimethyl [1~2~,2~2~:2~6~,3~2~-terpyridine]-1~4~,2~4~,3~4~-tricarboxylate, Trimethyl 2,2 inverted exclamation mark :6 inverted exclamation mark ,2 inverted exclamation mark inverted exclamation mark -Terpyridine-4,4 inverted exclamation mark ,4 inverted exclamation mark inverted exclamation mark -tricarboxylate, Trimethyl 2,2 inverted exclamation marka:6 inverted exclamation marka,2 inverted exclamation marka-terpyridine-4,4 inverted exclamation marka,4 inverted exclamation marka-tricarboxylate, YDXTYOYBYASPDS-UHFFFAOYSA-N, T2959, TRIMETHYL2,2':6',2''-TERPYRIDINE-4,4',4''-TRICARBOXYLATE, Trimethyl 2,2':6',2''-terpyridine-4,4',4''-tricarboxylate, 98% - 100MG 100mg,

Complexity	586
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	407.112g/mol
Formal Charge	0
Heavy Atom Count	30
Hydrogen Bond Acceptor Count	9
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	407.382g/mol
Monoisotopic Mass	407.112g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	118A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

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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