AG000KO7

123464-89-1 | Benzamide, N-(3R)-1-azabicyclo[2.2.2]oct-3-yl-4-chloro-, hydrochloride (1:1)

AG000KO7

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CAS Number	123464-89-1
Catalog Number	AG000KO7(AGN-PC-0PHJ7N)
Chemical Name	Benzamide, N-(3R)-1-azabicyclo[2.2.2]oct-3-yl-4-chloro-, hydrochloride (1:1)
IUPAC Name	N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-4-chlorobenzamide;hydrochloride
InChI	InChI=1S/C14H17ClN2O.ClH/c15-12-3-1-11(2-4-12)14(18)16-13-9-17-7-5-10(13)6-8-17;/h1-4,10,13H,5-9H2,(H,16,18);1H/t13-;/m0./s1
InChI Key	HSEQUIRZHDYOIX-ZOWNYOTGSA-N
MDL Number	MFCD08703110
Molecular Formula	C14H18Cl2N2O
Molecular Weight	301.2115
SMILES	Cl.N12C[C@@H](C(CC1)CC2)NC(C2=CC=C(C=C2)Cl)=O
UNII	810P1694K2
Synonyms	N-((3R)-1-Azabicyclo(2.2.2)oct-3-yl)-4-chlorobenzamide hydrochloride, PNU 282987, PNU-282987, PNU282987, PNU-282987, 123464-89-1, UNII-810P1694K2, (R)-4-Chloro-N-(quinuclidin-3-yl)benzamide hydrochloride, 810P1694K2, PNU-282,987, N-((3R)-1-Azabicyclo(2.2.2)oct-3-yl)-4-chlorobenzamide hydrochloride, CHEMBL554984, Benzamide, N-(3R)-1-azabicyclo(2.2.2)oct-3-yl-4-chloro-, hydrochloride (1:1), N-[(3R)-1-azabicyclo[2.2.2]oct-3-yl]-4-chlorobenzamide hydrochloride, Benzamide, N-(3R)-1-azabicyclo[2.2.2]oct-3-yl-4-chloro-, hydrochloride (1:1), C14H17ClN2O.ClH, PNU-282,987 hydrate, PNU 282987 hydrochloride, PNU282987 HCl, SCHEMBL1118980, KS-00001CZJ, AOB5089, EX-A1066, Tox21_500939, 2929AH, HY-12560A, Benzamide, N-(3R)-1-azabicyclo(2.2.2)oct-3-yl-4-chloro-, monohydrochloride, CCG-222243, CS-3810, LP00939, Benzamide, N-1-azabicyclo(2.2.2)oct-3-yl-4-chloro-, monohydrochloride, (R)-, NCGC00261624-01, J-004947, Q7119896, HSEQUIRZHDYOIX-ZOWNYOTGSA-N, PNU 282987, CID11243536, A11233, 711085-63-1,

Complexity	307
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	300.079619g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	301.2g/mol
Monoisotopic Mass	300.079619g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	32.3Ų
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

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