AG0080TH

1188264-74-5 | tert-Butyl 3-bromo-5,6-dihydroimidazo[1,5-a]pyrazine-7(8H)-carboxylate

AG0080TH

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CAS Number	1188264-74-5
Catalog Number	AG0080TH(AGN-PC-0J0XTN)
Chemical Name	tert-Butyl 3-bromo-5,6-dihydroimidazo[1,5-a]pyrazine-7(8H)-carboxylate
IUPAC Name	tert-butyl 3-bromo-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxylate
InChI	InChI=1S/C11H16BrN3O2/c1-11(2,3)17-10(16)14-4-5-15-8(7-14)6-13-9(15)12/h6H,4-5,7H2,1-3H3
InChI Key	AFGKBPUFODGXJD-UHFFFAOYSA-N
MDL Number	MFCD13152219
Molecular Formula	C11H16BrN3O2
Molecular Weight	302.1676
SMILES	O=C(N1CC2=CN=C(Br)N2CC1)OC(C)(C)C
Synonyms	1188264-74-5, tert-Butyl 3-bromo-5,6-dihydroimidazo[1,5-a]pyrazine-7(8H)-carboxylate, CTK8B8056, KS-00001CCH, DTXSID10743214, 3165AA, ANW-59290, MFCD13152219, ZINC40443074, AKOS016002194, AB66545, FCH1624478, AK-38909, DA-18937, DS-13061, QC-11603, AJ-102391, AX8163627, TC-148035, 4CH-021417, FT-0709501, ST24049804, 3-Bromo-7-Boc-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazine, t-Butyl 3-bromo-5,6-dihydroimidazo[1,5-a]pyrazine-7(8H)-carboxylate, tert-butyl 3-bromo-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxylate, C11H16BrN3O2, tert-Butyl3-bromo-5,6-dihydroimidazo[1,5-a]pyrazine-7(8H)-carboxylate,

Complexity	306
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	301.043g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	302.172g/mol
Monoisotopic Mass	301.043g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	47.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

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

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