AG003NDH

885281-30-1 | 7-Boc-5,6-dihydro-8h-imidazo[1,2-a]pyrazine-2-carboxylic acid

AG003NDH

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CAS Number	885281-30-1
Catalog Number	AG003NDH(AGN-PC-078TOJ)
Chemical Name	7-Boc-5,6-dihydro-8h-imidazo[1,2-a]pyrazine-2-carboxylic acid
IUPAC Name	7-[(2-methylpropan-2-yl)oxycarbonyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxylic acid
InChI	InChI=1S/C12H17N3O4/c1-12(2,3)19-11(18)15-5-4-14-6-8(10(16)17)13-9(14)7-15/h6H,4-5,7H2,1-3H3,(H,16,17)
InChI Key	YUBMPMRXTOOBIU-UHFFFAOYSA-N
MDL Number	MFCD08059256
Molecular Formula	C12H17N3O4
Molecular Weight	267.2811
SMILES	O=C(C1=CN2C(CN(C(OC(C)(C)C)=O)CC2)=N1)O
Synonyms	885281-30-1, 7-Boc-5,6-Dihydro-8H-imidazo[1,2-a]pyrazine-2-carboxylic acid, 7-(tert-butoxycarbonyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-2-carboxylic acid, 7-Boc-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-2-carboxylic Acid, 5,6-Dihydro-8H-imidazo[1,2-a]pyrazine-2,7-dicarboxylic acid 7-tert-butyl ester, Q-103545, 7-Boc-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-2-carboxylicAcid, 7-[(2-methylpropan-2-yl)oxycarbonyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxylic acid, PubChem18344, SCHEMBL1817445, CTK8B7174, KS-00000CLS, DTXSID60659437, YUBMPMRXTOOBIU-UHFFFAOYSA-N, 4273AC, ANW-56620, CT0121, KM2663, MFCD08059256, ZINC40434631, AKOS015910101, RP29525, TRA0036145, AN-26642, AS-30362, BC682275, SY008693, AJ-101930, AX8110092, DB-002247, RT-021135, 4CH-023735, AM20120275, FT-0648976, ST24045571, MFCD08059256 (97+%), 281B301, A842672, I14-3003, 5,6-DIHYDRO-8H-IMIDAZO[1,2-A]PYRAZINE-2,7-DICARBOXYLIC ACID-7-TERTBUTYL ESTER, 7-tert-butoxycarbonyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxylic acid, 7-[(2-methylpropan-2-yl)oxy-oxomethyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine-2-carboxylic acid, C12H17N3O4, 7- -5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-2-carboxylicacid,

Complexity	380
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	267.122g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	267.285g/mol
Monoisotopic Mass	267.122g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	84.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.3

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

Certificate of Analysis

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