AG003NDF

723286-79-1 | 5,6-DIHYDRO-8H-[1,2,4]TRIAZOLO[4,3-A]PYRAZINE-7-CARBOXYLIC ACID TERT-BUTYL ESTER

AG003NDF

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CAS Number	723286-79-1
Catalog Number	AG003NDF(AGN-PC-07XTJC)
Chemical Name	5,6-DIHYDRO-8H-[1,2,4]TRIAZOLO[4,3-A]PYRAZINE-7-CARBOXYLIC ACID TERT-BUTYL ESTER
IUPAC Name	tert-butyl 6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-7-carboxylate
InChI	InChI=1S/C10H16N4O2/c1-10(2,3)16-9(15)13-4-5-14-7-11-12-8(14)6-13/h7H,4-6H2,1-3H3
InChI Key	OKVLFQQWHATAHW-UHFFFAOYSA-N
MDL Number	MFCD10574958
Molecular Formula	C10H16N4O2
Molecular Weight	224.2596
SMILES	CC(C)(C)OC(=O)N1CCN2C=NN=C2C1
Synonyms	723286-79-1, tert-butyl 5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxylate, 7-Boc-5,6,7,8-tetrahydro-1,2,4-triazolo[4,3-a]pyrazine, 5,6-Dihydro-8H-[1,2,4]triazolo[4,3-a]pyrazine-7-carboxylic acid tert-butyl ester, tert-Butyl 5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxylate, tert-butyl 6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-7-carboxylate, OKVLFQQWHATAHW-UHFFFAOYSA-N, SCHEMBL4400866, CTK5D5926, DTXSID20674303, 7-N-Boc-5,6-dihydro-8H-[1,2,4]triazolo[4,3-a]pyrazine, ANW-63865, CB-350, CT0169, MFCD10574958, ZINC35635962, AKOS013247046, CS-W000013, RP27520, RTX-012579, TRA0024130, KS-00000E88, AJ-91989, AK-67964, CS-11330, SY016037, AB0039233, DB-002303, ST2413922, 4CH-010131, FT-0688929, Y6666, C-2154, MFCD10574958 (95+%), 574D958, A837490, AN-584/43510716, J-516535, I14-17079, tert-butyl 5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-carboxylate, tert-Butyl 5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyrazine-7-carboxylate, tert-butyl5,6-dihydro-[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxylate, 6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-7-carboxylic acid tert-butyl ester, 7-(tert-Butoxycarbonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazine, tert-Butyl 5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazine-7(8H)-carboxylate, AldrichCPR, C10H16N4O2, tert-butyl 4-(chlorosulfonyl)piperazine-1carboxylate, 162046-65-3,

Complexity	277
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	224.127g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	224.264g/mol
Monoisotopic Mass	224.127g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	60.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H302-H315-H319-H335
Packing Group	Ⅲ
Precautionary statements	P261-P305+P351+P338
UN Code	UN 2811

Certificate of Analysis

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