Home Other Building Blocks 2-thia-5-azabicyclo[4.2.0]octane hydrochloride

2-thia-5-azabicyclo[4.2.0]octane hydrochloride

CAS No.:
1955554-05-8
Catalog Number:
AG01B6AR
Molecular Formula:
C6H12ClNS
Molecular Weight:
165.6842
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Product Description
Catalog Number:
AG01B6AR
Chemical Name:
2-thia-5-azabicyclo[4.2.0]octane hydrochloride
CAS Number:
1955554-05-8
Molecular Formula:
C6H12ClNS
Molecular Weight:
165.6842
MDL Number:
MFCD30181335
IUPAC Name:
2-thia-5-azabicyclo[4.2.0]octane;hydrochloride
InChI:
InChI=1S/C6H11NS.ClH/c1-2-6-5(1)7-3-4-8-6;/h5-7H,1-4H2;1H
InChI Key:
PYOGCBMLDARCMQ-UHFFFAOYSA-N
SMILES:
C1CSC2C(N1)CC2.Cl
Properties
Complexity:
94.5  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.038g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
165.679g/mol
Monoisotopic Mass:
165.038g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
Properties