Home Aminos 3-amino-8lambda6-thiabicyclo[3.2.1]octane-8,8-dione hydrochloride

3-amino-8lambda6-thiabicyclo[3.2.1]octane-8,8-dione hydrochloride

CAS No.:
2126162-54-5
Catalog Number:
AG01EJHZ
Molecular Formula:
C7H14ClNO2S
Molecular Weight:
211.7096
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Product Description
Catalog Number:
AG01EJHZ
Chemical Name:
3-amino-8lambda6-thiabicyclo[3.2.1]octane-8,8-dione hydrochloride
CAS Number:
2126162-54-5
Molecular Formula:
C7H14ClNO2S
Molecular Weight:
211.7096
MDL Number:
MFCD31381351
IUPAC Name:
8,8-dioxo-8λ6-thiabicyclo[3.2.1]octan-3-amine;hydrochloride
InChI:
InChI=1S/C7H13NO2S.ClH/c8-5-3-6-1-2-7(4-5)11(6,9)10;/h5-7H,1-4,8H2;1H
InChI Key:
XDKUBKHWJSLOTQ-UHFFFAOYSA-N
SMILES:
NC1CC2CCC(C1)S2(=O)=O.Cl
Properties
Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.043g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
211.704g/mol
Monoisotopic Mass:
211.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
Properties