AG00C0PX

427878-70-4 | Pyrrolo[2,1-f][1,2,4]triazine-6-carboxylic acid, 1,4-dihydro-5-methyl-4-oxo-, ethyl ester

AG00C0PX

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CAS Number	427878-70-4
Catalog Number	AG00C0PX(AGN-PC-00BU7G)
Chemical Name	Pyrrolo[2,1-f][1,2,4]triazine-6-carboxylic acid, 1,4-dihydro-5-methyl-4-oxo-, ethyl ester
IUPAC Name	ethyl 5-methyl-4-oxo-3H-pyrrolo[2,1-f][1,2,4]triazine-6-carboxylate
InChI	InChI=1S/C10H11N3O3/c1-3-16-10(15)7-4-13-8(6(7)2)9(14)11-5-12-13/h4-5H,3H2,1-2H3,(H,11,12,14)
InChI Key	XCUHVGKOOKXZNK-UHFFFAOYSA-N
MDL Number	MFCD11044884
Molecular Formula	C10H11N3O3
Molecular Weight	221.2126
SMILES	CCOC(=O)c1cn2nc[nH]c(=O)c2c1C
Synonyms	427878-70-4, Ethyl 5-methyl-4-oxo-1,4-dihydropyrrolo[2,1-f][1,2,4]triazine-6-carboxylate, Ethyl 5-methyl-4-oxo-3,4-dihydropyrrolo[1,2-f][1,2,4]triazine-6-carboxylate, ETHYL 4-HYDROXY-5-METHYLPYRROLO[2,1-F][1,2,4]TRIAZINE-6-CARBOXYLATE, C10H11N3O3, ethyl 5-methyl-4-oxo-3H,4H-pyrrolo[2,1-f][1,2,4]triazine-6-carboxylate, AK120807, Pyrrolo[2,1-f][1,2,4]triazine-6-carboxylic acid, 1,4-dihydro-5-methyl-4-oxo-, ethyl ester, W-202741, ETHYL 4-HYDROXY-5-METHYLPYRROLO[1,2-F][1,2,4]TRIAZINE-6-CARBOXYLATE, 5-methyl-4-oxo-3,4-dihydro-pyrrolo[2,1-f][1,2,4]triazine-6-carboxylic acid ethyl ester, ETHYL 5-METHYL-4-OXO-3,4-DIHYDROPYRROLO[2,1-F][1,2,4]TRIAZINE-6-CARBOXYLATE, SCHEMBL1227597, DTXSID80468765, XCUHVGKOOKXZNK-UHFFFAOYSA-N, CS-M1177, MFCD11044884, MFCD12408334, ZINC30678293, AKOS015949589, AKOS016011496, AN-5915, DS-6275, PB28442, QC-1049, RP07230, AC-25048, AJ-84039, SC-35024, AB0094973, AX8246223, DB-026877, 4CH-022180, FT-0685566, Y9097, Q-2219, Ethyl 5-methyl-4-oxo-3,4-dihydropyrrolo[1,2-f][1,2, Ethyl 4-hydroxy-5-methylpyrrolo[1,2-f][1,2,4] triazine-6-carboxylate, ethyl 5-methyl-4-oxo-1H-pyrrolo[2,1-f][1,2,4]triazine-6-carboxylate, ethyl 5-methyl-4-oxo-3H-pyrrolo[2,1-f][1,2,4]triazine-6-carboxylate, ethyl4-hydroxy-5-methylpyrrolo[1,2-f][1,2,4]triazine-6-carboxylate, 4-hydroxy-5-methyl-pyrrolo[2,1-f][1,2,4]triazine-6-carboxylic acid ethyl ester, 4-hydroxy-5-methylpyrrolo[2,1-f][1,2,4]triazine-6-carboxylic acid ethyl ester, 5-Methyl-4-oxo-3,4-dihydro-pyrrolo[2,1-f]-1,2,4-triazine-6-carboxylic acid ethyl ester, Ethyl 3,4-dihydro-5-methyl-4-oxopyrrolo[1,2-f][1,2,4]triazine-6-carboxylate, Ethyl 4-hydroxy-5-methylpyrrolo[1,2-f][1,2,4] triazine-6-carboxylate, AldrichCPR, ethyl 5-methyl-4-oxo-1,4-dihydropyrrolo[1,2-f][1,2,4]triazine-6-carboxylate, Ethyl 5-Methyl-4-oxo-3,4-dihydro-pyrrolo[2,1-f][1,2,4]triazine-6-carboxylate, Ethyl 5-methyl-4-oxo-3,4-dihydropyrrolo[2,1-f]-1,2,4-triazine-6-carboxylate, CID11572090, A6945, Ethyl 7-methyl-5-oxo-1,2,4-triazabicyclo[4.3.0]nona-3,6,8-triene-8-carboxylate, Ethyl5-methyl-4-oxo-1,4-dihydropyrrolo[2,1-f][1,2,4]triazine-6-carboxylate, Ethyl ester 1,4-dihydro-5-methyl-4-oxo-pyrrolo[2,1-f][1,2,4]triazine-6-carboxylic acid, 97+%,

Complexity	342
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	221.08g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	221.216g/mol
Monoisotopic Mass	221.08g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	72.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number