AG007PUN

120570-05-0 | (S)-quinuclidin-3-amine

AG007PUN

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CAS Number	120570-05-0
Catalog Number	AG007PUN(AGN-PC-0O065N)
Chemical Name	(S)-quinuclidin-3-amine
IUPAC Name	(3S)-1-azabicyclo[2.2.2]octan-3-amine
InChI	InChI=1S/C7H14N2/c8-7-5-9-3-1-6(7)2-4-9/h6-7H,1-5,8H2/t7-/m1/s1
InChI Key	REUAXQZIRFXQML-SSDOTTSWSA-N
MDL Number	MFCD08669631
Molecular Formula	C7H14N2
Molecular Weight	126.1995
SMILES	N[C@@H]1CN2CCC1CC2
Synonyms	(S)-quinuclidin-3-amine, 120570-05-0, (S)-3-aminoquinuclidine, (3S)-1-azabicyclo[2.2.2]octan-3-amine, 1-Azabicyclo[2.2.2]octan-3-amine, (S)-, 1-Azabicyclo[2.2.2]octan-3-amine, (3S)-, (3S)-Aminoquinuclidine Dihydrochloride, (S)-1-Aza-bicyclo[2.2.2]oct-3-ylamine, (S)-3-Aminoquinuclidine hydrochloride, (3S)-1-Azabicyclo[2.2.2]octan-3-amine Hydrochloride, AC1LEWO8, AC1Q4UA6, (3S)-Quinuclidine-3-amine, SCHEMBL47241, (S)-(-)-3-aminoquinuclidine, AZA014, SCHEMBL17203543, CTK0F8744, REUAXQZIRFXQML-SSDOTTSWSA-N, BCP08732, CS-B0281, 9233AH, FCH833739, MFCD08669631, ZINC19202661, AKOS006237379, AKOS017344552, ACN-025423, NE64346, AJ-72555, AK163160, AS-39361, (S)-1-azabicyclo[2.2.2]oct-3-ylamine, (S)-3-amino-1-azabicyclo[2.2.2]octane, AX8248347, ST24036383, (S)-(-)-1-azabicyclo[2.2.2]octan-3-amine, (S)-(1-Aza-bicyclo[2.2.2]oct-3-yl)amine, (3S)-3-Amino-1-azabicyclo[2.2.2]octane Dihydrochloride, C7H14N2, 3-Aminoquinuclidine dihydrochloride, CID719216, (S)-Quinuclidin-3-amine dihydrochloride, (S)-(-)-3-Aminoquinuclidine dihydrochloride, 119904-90-4, N/A,

Complexity	106
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	126.116g/mol
Formal Charge	0
Heavy Atom Count	9
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	126.203g/mol
Monoisotopic Mass	126.116g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	29.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H314
Precuationary statements	P280-P305+P351+P338-P310
Siginal words

Certificate of Analysis

Lot Number