AG0017XM

1380679-97-9 | 5-tert-Butyl 4-ethyl 3-methyl-6,7-dihydro-3H-imidazo[4,5-c]pyridine-4,5(4H)-dicarboxylate

AG0017XM

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CAS Number	1380679-97-9
Catalog Number	AG0017XM(AGN-PC-0WD702)
Chemical Name	5-tert-Butyl 4-ethyl 3-methyl-6,7-dihydro-3H-imidazo[4,5-c]pyridine-4,5(4H)-dicarboxylate
IUPAC Name	5-O-tert-butyl 4-O-ethyl 3-methyl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-4,5-dicarboxylate
InChI	InChI=1S/C15H23N3O4/c1-6-21-13(19)12-11-10(16-9-17(11)5)7-8-18(12)14(20)22-15(2,3)4/h9,12H,6-8H2,1-5H3
InChI Key	PUFOAZLZNZRRPN-UHFFFAOYSA-N
MDL Number	MFCD22393526
Molecular Formula	C15H23N3O4
Molecular Weight	309.3608
SMILES	CCOC(=O)C1N(CCC2=C1N(C)C=N2)C(=O)OC(C)(C)C
Synonyms	1380679-97-9, 5-tert-butyl 4-ethyl 3-methyl-6,7-dihydro-3H-imidazo[4,5-c]pyridine-4,5(4H)-dicarboxylate, AMOT0437, MFCD22393526, AKOS025287333, AM86016, DS-9532, AK167548, 5H-Imidazo[4,5-c]pyridine-4,5-dicarboxylic acid, 3,4,6,7-tetrahydro-3-methyl-, 5-(1,1-dimethylethyl) 4-ethyl ester,

Complexity	435
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	309.169g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	309.366g/mol
Monoisotopic Mass	309.169g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	73.7A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.3

GHS Hazard and Precautionary Statements

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

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