AG01DOFV

889945-69-1 | tert-Butyl 4-(1H-indazol-3-yl)piperidine-1-carboxylate

AG01DOFV

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CAS Number	889945-69-1
Catalog Number	AG01DOFV(AGN-PC-0WD2KW)
Chemical Name	tert-Butyl 4-(1H-indazol-3-yl)piperidine-1-carboxylate
IUPAC Name	tert-butyl 4-(2H-indazol-3-yl)piperidine-1-carboxylate
InChI	InChI=1S/C17H23N3O2/c1-17(2,3)22-16(21)20-10-8-12(9-11-20)15-13-6-4-5-7-14(13)18-19-15/h4-7,12H,8-11H2,1-3H3,(H,18,19)
InChI Key	XVOLPXSAAZXUSP-UHFFFAOYSA-N
MDL Number	MFCD08166358
Molecular Formula	C17H23N3O2
Molecular Weight	301.3834
SMILES	O=C(N1CCC(C2=NNC3=C2C=CC=C3)CC1)OC(C)(C)C
Synonyms	tert-Butyl 4-(1H-indazol-3-yl)piperidine-1-carboxylate, 889945-69-1, 1-Boc-4-(1H-indazol-3-yl)piperidine, SCHEMBL14737550, CTK7G2791, DTXSID60678042, XVOLPXSAAZXUSP-UHFFFAOYSA-N, 4680AC, MFCD08166358, ZINC71257569, AK134725, AJ-117857, AX8256493, tert-butyl 4-(2H-indazol-3-yl)piperidine-1-carboxylate, C17H23N3O2, tert-Butyl4-(1H-indazol-3-yl)piperidine-1-carboxylate, 1393545-49-7, 916176-50-6,

Complexity	399
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	301.179g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	301.39g/mol
Monoisotopic Mass	301.179g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	58.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number