Home Other Building Blocks 3-thia-7-azabicyclo[3.3.1]nonane hydrochloride

3-thia-7-azabicyclo[3.3.1]nonane hydrochloride

CAS No.:
2137536-36-6
Catalog Number:
AG01EJ10
Molecular Formula:
C7H14ClNS
Molecular Weight:
179.7108
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Product Description
Catalog Number:
AG01EJ10
Chemical Name:
3-thia-7-azabicyclo[3.3.1]nonane hydrochloride
CAS Number:
2137536-36-6
Molecular Formula:
C7H14ClNS
Molecular Weight:
179.7108
MDL Number:
MFCD31457176
IUPAC Name:
3-thia-7-azabicyclo[3.3.1]nonane;hydrochloride
InChI:
InChI=1S/C7H13NS.ClH/c1-6-2-8-3-7(1)5-9-4-6;/h6-8H,1-5H2;1H
InChI Key:
OIIUOVYTTHUQMQ-UHFFFAOYSA-N
SMILES:
N1CC2CSCC(C1)C2.Cl
Properties
Complexity:
95.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.054g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
179.706g/mol
Monoisotopic Mass:
179.054g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
Properties