AG00C056

426829-52-9 | 6'-Chloro-2,3,5,6-tetrahydro-[1,2']bipyrazinyl-4-carboxylic acid tert-butyl ester

AG00C056

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CAS Number	426829-52-9
Catalog Number	AG00C056(AGN-PC-0WAZYR)
Chemical Name	6'-Chloro-2,3,5,6-tetrahydro-[1,2']bipyrazinyl-4-carboxylic acid tert-butyl ester
IUPAC Name	tert-butyl 4-(6-chloropyrazin-2-yl)piperazine-1-carboxylate
InChI	InChI=1S/C13H19ClN4O2/c1-13(2,3)20-12(19)18-6-4-17(5-7-18)11-9-15-8-10(14)16-11/h8-9H,4-7H2,1-3H3
InChI Key	XTDKNKUNEVLULA-UHFFFAOYSA-N
MDL Number	MFCD07368260
Molecular Formula	C13H19ClN4O2
Molecular Weight	298.7686
SMILES	ClC1=CN=CC(N2CCN(C(OC(C)(C)C)=O)CC2)=N1
Synonyms	426829-52-9, 1-N-Boc-4-(6-Chloropyrazin-2-yl)piperazine, 6'-Chloro-2,3,5,6-tetrahydro-[1,2']bipyrazinyl-4-carboxylic acid tert-butyl ester, TERT-BUTYL 4-(6-CHLOROPYRAZIN-2-YL)PIPERAZINE-1-CARBOXYLATE, 1-Piperazinecarboxylicacid, 4-(6-chloro-2-pyrazinyl)-, 1,1-dimethylethyl ester, SCHEMBL1432444, CTK4I6513, DTXSID30592685, XTDKNKUNEVLULA-UHFFFAOYSA-N, KS-000025XL, MFCD07368260, ZINC44137216, AKOS025311097, AB32009, GS-3436, AB0009520, DB-070329, RT-006375, FT-0760555, A-2543, 2-chloro-6-(4-t-butoxycarbonylpiperazin-1-yl)pyrazine, Tert-Butyl 4-(6-Chloro-2-Pyrazinyl)-1-Piperazinecarboxylate, tert-Butyl 4-(6-chloropyrazin-2-yl)-1-piperazinecarboxylate, tert-butyl-4-(6-chloro-pyrazin-2-yl)-piperazine-1-carboxylate, tert-BUTYL-4-(6-CHLORO-PYRAZIN-2-YL)-PIPERAZINE-1-CARBOXYATE, 6'-chloro-2,3,5,6-tetrahydro-[1,2']-bipyrazinyl-4-carboxylic acid tert-butyl ester, 6'-Chloro-2,3,5,6-tetrahydro-[1,2'bipyrazinyl-4-carboxylic acid tert-butyl ester, 6'-chloro-2,3,5,6-tetrahydro-[1,2]bipyrazinyl-4-carboxylic acid tert-butyl ester, 6'-chloro-2,3,5,6-tetrahydro-[1,2]bipyrazinyl4-carboxylic acid tert-butyl ester, 6'-chloro-2,3,5,6-tetrahydro-1,2'-bipyrazinyl-4-carboxylic acid tert-butyl ester, C13H19ClN4O2, 6'-CHLORO-2,3,5,6-TETRAHYDRO-[1,2']BIPYRAZINYL-4-CARBOXYLICACIDTERT-BUTYLESTER,

Complexity	340
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	298.12g/mol
Formal Charge	0
Heavy Atom Count	20
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	298.771g/mol
Monoisotopic Mass	298.12g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	58.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P280-P301+P312-P302+P352-P305+P351+P338
UN Code

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