AG004KDG

871726-73-7 | tert-butyl 4,5-dihydro-1H-pyrazolo[3,4-c]pyridine-6(7H)-carboxylate

AG004KDG

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CAS Number	871726-73-7
Catalog Number	AG004KDG(AGN-PC-0BS6O4)
Chemical Name	tert-butyl 4,5-dihydro-1H-pyrazolo[3,4-c]pyridine-6(7H)-carboxylate
IUPAC Name	tert-butyl 1,4,5,7-tetrahydropyrazolo[3,4-c]pyridine-6-carboxylate
InChI	InChI=1S/C11H17N3O2/c1-11(2,3)16-10(15)14-5-4-8-6-12-13-9(8)7-14/h6H,4-5,7H2,1-3H3,(H,12,13)
InChI Key	XSHYMCSSTAWZOW-UHFFFAOYSA-N
MDL Number	MFCD11044813
Molecular Formula	C11H17N3O2
Molecular Weight	223.2716
SMILES	O=C(N1CCC2=C(NN=C2)C1)OC(C)(C)C
Synonyms	871726-73-7, tert-Butyl 4,5-dihydro-1H-pyrazolo[3,4-c]pyridine-6(7H)-carboxylate, 1,4,5,7-TETRAHYDRO-6H-PYRAZOLO[3,4-C]PYRIDINE-6-CARBOXYLIC ACID TERT-BUTYL ESTER, tert-butyl 1,4,5,7-tetrahydropyrazolo[3,4-c]pyridine-6-carboxylate, tert-Butyl 4,5-dihydro-2H-pyrazolo[3,4-c]pyridine-6(7H)-carboxylate, 2,4,5,7-Tetrahydro-pyrazolo[3,4-c]pyridine-6-carboxylic acid tert-butyl ester, 2088956-97-0, SCHEMBL8223979, SCHEMBL19005682, CTK8B5452, KS-00000OEJ, DTXSID20720975, XSHYMCSSTAWZOW-UHFFFAOYSA-N, TERT-BUTYL 4,5-DIHYDRO-1H-PYRAZOLO[3,4-C]PYRIDINE-, CS-B1004, ANW-48774, MFCD11044813, ZINC72482104, AKOS015920396, TERT-BUTYL 1H,4H,5H,6H,7H-PYRAZOLO[3,4-C]PYRIDINE-6-CARBOXYLATE, AB62956, LS40143, AC-28407, AK-39955, BR-39955, DS-13162, SC-53109, AB0027147, AJ-121171, DB-076864, TC-137519, FT-0753156, ST24031776, W8945, S-7363, Z-9348, 6-BOC-2,4,5,7-Tetrahydro-pyrazolo[3,4-c]pyridine, tert-butyl 2H,4H,5H,6H,7H-pyrazolo[3,4-c]pyridine-6-carboxylate, T-BUTYL 4,5-DIHYDRO-1H-PYRAZOLO[3,4-C]PYRIDINE-6(7H)-CARBOXYLATE, 1,4,5,7-TETRAHYDRO-PYRAZOLO[3,4-C]PYRIDINE-6-CARBOXYLIC ACID TERT-BUTYL ESTER, 1,4,5,7-Tetrahydro-pyrazolo3,4-cpyridine-6-carboxylic acid tert-butyl ester, TERT-BUTYL 1,4,5,7-TETRAHYDRO-6H-PYRAZOLO[3,4-C]PYRIDINE-6-CARBOXYLATE, tert-Butyl 4,5-dihydro-1H-pyrazolo[3,4-c]pyridine-6(7H)-carboxylate-6(7H)-carboxylate, C11H17N3O2, tert-butyl 4,5-dihydro-1H-pyrazolo[3,4-c]pyridine-6(7H)-carboxylate, 95% - 1G 1g,

Complexity	275
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	223.132g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	223.276g/mol
Monoisotopic Mass	223.132g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	58.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number