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Home Other Building Blocks 6-Oxa-3-azabicyclo[3.1.1]heptane tosylate

6-Oxa-3-azabicyclo[3.1.1]heptane tosylate

CAS No.:
1339953-58-0
Catalog Number:
AG003ABJ
Molecular Formula:
C12H17NO4S
Molecular Weight:
271.3327
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$105
- +
250mg
95%
In Stock USA
United States
$189
- +
1g
95%
In Stock USA
United States
$378
- +
5g
95%
In Stock USA
United States
$1614
- +
Product Description
Catalog Number:
AG003ABJ
Chemical Name:
6-Oxa-3-azabicyclo[3.1.1]heptane tosylate
CAS Number:
1339953-58-0
Molecular Formula:
C12H17NO4S
Molecular Weight:
271.3327
MDL Number:
MFCD27665413
IUPAC Name:
4-methylbenzenesulfonic acid;6-oxa-3-azabicyclo[3.1.1]heptane
InChI:
InChI=1S/C7H8O3S.C5H9NO/c1-6-2-4-7(5-3-6)11(8,9)10;1-4-2-6-3-5(1)7-4/h2-5H,1H3,(H,8,9,10);4-6H,1-3H2
InChI Key:
GQPGLNRUOSQXDM-UHFFFAOYSA-N
SMILES:
N1CC2CC(C1)O2.Cc1ccc(cc1)S(=O)(=O)O
Properties
Complexity:
283  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.088g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
271.331g/mol
Monoisotopic Mass:
271.088g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
84A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
Properties