AG01DZID

Name: rac 3-Hydroxy-3-mercaptomethylquinuclidine
Brand: Angene Chemical
SKU: AG01DZID

107220-26-8 | rac 3-Hydroxy-3-mercaptomethylquinuclidine

AG01DZID

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CAS Number	107220-26-8
Catalog Number	AG01DZID(AGN-PC-00Q1MY)
Chemical Name	rac 3-Hydroxy-3-mercaptomethylquinuclidine
IUPAC Name	3-(sulfanylmethyl)-1-azabicyclo[2.2.2]octan-3-ol
InChI	InChI=1S/C8H15NOS/c10-8(6-11)5-9-3-1-7(8)2-4-9/h7,10-11H,1-6H2
InChI Key	OBEOJOQKVZXCRH-UHFFFAOYSA-N
MDL Number	MFCD11042346
Molecular Formula	C8H15NOS
Molecular Weight	173.2758
SMILES	OC1(CS)CN2CCC1CC2
Synonyms	107220-26-8, 3-hydroxy-3-mercaptomethylquinuclidine, 3-(Mercaptomethyl)-1-azabicyclo[2.2.2]octan-3-ol, 1-Azabicyclo[2.2.2]octan-3-ol,3-(mercaptomethyl)-, rac 3-Hydroxy-3-mercaptomethylquinuclidine, 1-Azabicyclo[2.2.2]octan-3-ol, 3-(mercaptomethyl)-, SCHEMBL3915139, 3-Mercaptomethylquinuclidin-3-ol, DTXSID90456118, OBEOJOQKVZXCRH-UHFFFAOYSA-N, BCP15100, 3-hydroxy 3-mecapto methylquinuclidine, AKOS006307048, AKOS015911927, FT-0669733, 3-(sulfanylmethyl)-1-azabicyclo[2.2.2]octan-3-ol, J-001738, I14-36891, CID11126763, 8-(sulfanylmethyl)-1-azabicyclo[2.2.2]octan-8-ol,

Complexity	156
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	173.087g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	173.274g/mol
Monoisotopic Mass	173.087g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	24.5A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.3

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited